200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 127792-81-8
127792-81-8 | 1H-Indole-5-carbonitrile, 3-(1,2,3,6-tetrahydro-4-pyridinyl)-
CAS No: 127792-81-8 Catalog No: AG000XF2 MDL No:
Product Description
Catalog Number:
AG000XF2
Chemical Name:
1H-Indole-5-carbonitrile, 3-(1,2,3,6-tetrahydro-4-pyridinyl)-
CAS Number:
127792-81-8
Molecular Formula:
C14H13N3
Molecular Weight:
223.2731
IUPAC Name:
3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole-5-carbonitrile
InChI:
InChI=1S/C14H13N3/c15-8-10-1-2-14-12(7-10)13(9-17-14)11-3-5-16-6-4-11/h1-3,7,9,16-17H,4-6H2
InChI Key:
VADZOZAUGGYKFE-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)c(c[nH]2)C1=CCNCC1
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.279g/mol
Monoisotopic Mass:
223.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.