N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride

C14H20Cl2N4O — CID 119566109

IUPACN-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
SMILESCl.Cl.NCC1(NC(=O)c2ccc3nccn3c2)CCCC1
InChIInChI=1S/C14H18N4O.2ClH/c15-10-14(5-1-2-6-14)17-13(19)11-3-4-12-16-7-8-18(12)9-11;;/h3-4,7-9H,1-2,5-6,10,15H2,(H,17,19);2*1H
InChIKeyLLZQZVOCJIDJJE-UHFFFAOYSA-N
MW331.25 g/mol
LogP2.18
Rot. Bonds3

About N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride

N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride (PubChem CID 119566109) has the molecular formula C14H20Cl2N4O and a molecular weight of 331.25 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
PubChem CID119566109
Molecular FormulaC14H20Cl2N4O
Molecular Weight331.25 g/mol
Exact Mass330.10
IUPAC NameN-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
SMILESCl.Cl.NCC1(NC(=O)c2ccc3nccn3c2)CCCC1
InChIInChI=1S/C14H18N4O.2ClH/c15-10-14(5-1-2-6-14)17-13(19)11-3-4-12-16-7-8-18(12)9-11;;/h3-4,7-9H,1-2,5-6,10,15H2,(H,17,19);2*1H
InChIKeyLLZQZVOCJIDJJE-UHFFFAOYSA-N
XLogP2.18
TPSA72.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.25
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride (CID 119566109) is N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride is Cl.Cl.NCC1(NC(=O)c2ccc3nccn3c2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
The InChIKey is LLZQZVOCJIDJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O.2ClH/c15-10-14(5-1-2-6-14)17-13(19)11-3-4-12-16-7-8-18(12)9-11;;/h3-4,7-9H,1-2,5-6,10,15H2,(H,17,19);2*1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride has a molecular weight of 331.25 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride is sourced from PubChem (CID 119566109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).