[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine

C13H18N4 — CID 117138282

IUPAC[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2cnc(CC3CCCN3)n2c1
InChIInChI=1S/C13H18N4/c14-7-10-3-4-12-8-16-13(17(12)9-10)6-11-2-1-5-15-11/h3-4,8-9,11,15H,1-2,5-7,14H2
InChIKeyGRHZMYZXBFHFOL-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.09
Rot. Bonds3

About [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine

[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine (PubChem CID 117138282) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine
PubChem CID117138282
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2cnc(CC3CCCN3)n2c1
InChIInChI=1S/C13H18N4/c14-7-10-3-4-12-8-16-13(17(12)9-10)6-11-2-1-5-15-11/h3-4,8-9,11,15H,1-2,5-7,14H2
InChIKeyGRHZMYZXBFHFOL-UHFFFAOYSA-N
XLogP1.09
TPSA55.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(pyrrolidin-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 117138284
(3-piperidin-2-ylimidazo[1,5-a]pyridin-6-yl)methanamine
CID 117138268
(3-pyrrolidin-3-ylimidazo[1,5-a]pyridin-6-yl)methanamine
CID 117138184
2-[4-(pyrrolidin-2-ylmethyl)phenyl]ethanamine
CID 178108165
6-(pyrrolidin-2-ylmethyl)-1,2,3,4-tetrahydroimidazo[1,5-a]pyrimidine
CID 105459599
6-(piperidin-2-ylmethyl)imidazo[1,5-a]pyrimidine
CID 105470149
[3-(1,1-dioxothian-4-yl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138194
[2-(piperidin-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117134516
2-[[4-(2-fluoroethyl)phenyl]methyl]pyrrolidine
CID 117296650
5-chloro-2-(pyrrolidin-2-ylmethyl)pyridine
CID 82657762
2-[(4-methylphenyl)methyl]pyrrolidine
CID 3510571
3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol
CID 117148607

Frequently Asked Questions

What is the IUPAC name of [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
The IUPAC name of [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine (CID 117138282) is [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
The canonical SMILES for [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine is NCc1ccc2cnc(CC3CCCN3)n2c1.
What is the InChIKey of [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
The InChIKey is GRHZMYZXBFHFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c14-7-10-3-4-12-8-16-13(17(12)9-10)6-11-2-1-5-15-11/h3-4,8-9,11,15H,1-2,5-7,14H2.
What are the key properties of [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine?
[3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine has a molecular weight of 230.31 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 117138282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).