6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid

C14H18N4O2 — CID 117253584

IUPAC6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESNc1ccc2c(C(=O)O)nc(CC3CCCCN3)n2c1
InChIInChI=1S/C14H18N4O2/c15-9-4-5-11-13(14(19)20)17-12(18(11)8-9)7-10-3-1-2-6-16-10/h4-5,8,10,16H,1-3,6-7,15H2,(H,19,20)
InChIKeyWVWQBJJVNYQDRR-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.30
Rot. Bonds3

About 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid

6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 117253584) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID117253584
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESNc1ccc2c(C(=O)O)nc(CC3CCCCN3)n2c1
InChIInChI=1S/C14H18N4O2/c15-9-4-5-11-13(14(19)20)17-12(18(11)8-9)7-10-3-1-2-6-16-10/h4-5,8,10,16H,1-3,6-7,15H2,(H,19,20)
InChIKeyWVWQBJJVNYQDRR-UHFFFAOYSA-N
XLogP1.30
TPSA92.65 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117253586
5-chloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252965
5-methyl-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252973
methyl 6-hydroxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117253578
6-amino-3-(azepan-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117253551
5-chloro-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252949
8-methoxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254731
6-amino-3-(2-methoxyethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117250975
6-amino-3-pyrrolidin-3-ylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117251036
6-chloro-3-(pyrrolidin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117253630
methyl 6-amino-3-(azetidin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117253607
3-methyl-2-(piperidin-2-ylmethyl)benzimidazole-5-carboxylic acid
CID 84641963

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid (CID 117253584) is 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid is Nc1ccc2c(C(=O)O)nc(CC3CCCCN3)n2c1.
What is the InChIKey of 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is WVWQBJJVNYQDRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c15-9-4-5-11-13(14(19)20)17-12(18(11)8-9)7-10-3-1-2-6-16-10/h4-5,8,10,16H,1-3,6-7,15H2,(H,19,20).
What are the key properties of 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 274.32 g/mol, XLogP of 1.30, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 117253584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).