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Home > Pyridines > 1349702-32-4
1349702-32-4 | (S)-tert-Butyl 1-[(pyridin-4-yl)carbonyl]pyrrolidin-3-ylcarbamate
CAS No: 1349702-32-4 Catalog No: AG01ESCF MDL No:
Product Description
Catalog Number:
AG01ESCF
Chemical Name:
(S)-tert-Butyl 1-[(pyridin-4-yl)carbonyl]pyrrolidin-3-ylcarbamate
CAS Number:
1349702-32-4
Molecular Formula:
C15H21N3O3
Molecular Weight:
291.3455
IUPAC Name:
tert-butyl N-[(3S)-1-(pyridine-4-carbonyl)pyrrolidin-3-yl]carbamate
InChI:
InChI=1S/C15H21N3O3/c1-15(2,3)21-14(20)17-12-6-9-18(10-12)13(19)11-4-7-16-8-5-11/h4-5,7-8,12H,6,9-10H2,1-3H3,(H,17,20)/t12-/m0/s1
InChI Key:
ACVYQWRIYSTAMO-LBPRGKRZSA-N
SMILES:
O=C(OC(C)(C)C)N[C@H]1CCN(C1)C(=O)c1ccncc1
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
291.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.351g/mol
Monoisotopic Mass:
291.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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