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1249198-23-9 | 2-Pyrimidinamine, 4-(2-pyrrolidinyl)-
CAS No: 1249198-23-9 Catalog No: AG000MW8 MDL No:MFCD16093625
Product Description
Catalog Number:
AG000MW8
Chemical Name:
2-Pyrimidinamine, 4-(2-pyrrolidinyl)-
CAS Number:
1249198-23-9
Molecular Formula:
C8H12N4
Molecular Weight:
164.2077
MDL Number:
MFCD16093625
IUPAC Name:
4-pyrrolidin-2-ylpyrimidin-2-amine
InChI:
InChI=1S/C8H12N4/c9-8-11-5-3-7(12-8)6-2-1-4-10-6/h3,5-6,10H,1-2,4H2,(H2,9,11,12)
InChI Key:
JFWCVNMHIGHJRV-UHFFFAOYSA-N
SMILES:
Nc1nccc(n1)C1CCCN1
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.106g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
164.212g/mol
Monoisotopic Mass:
164.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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