N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride

C15H23Cl2N5O — CID 119392015

IUPACN-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(NCCCN1CCNCC1)c1ccc2nccn2c1
InChIInChI=1S/C15H21N5O.2ClH/c21-15(13-2-3-14-17-7-11-20(14)12-13)18-4-1-8-19-9-5-16-6-10-19;;/h2-3,7,11-12,16H,1,4-6,8-10H2,(H,18,21);2*1H
InChIKeyLKELEIMWNDHJCU-UHFFFAOYSA-N
MW360.29 g/mol
LogP1.20
Rot. Bonds5

About N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride

N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride (PubChem CID 119392015) has the molecular formula C15H23Cl2N5O and a molecular weight of 360.29 g/mol. Its IUPAC name is N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
PubChem CID119392015
Molecular FormulaC15H23Cl2N5O
Molecular Weight360.29 g/mol
Exact Mass359.13
IUPAC NameN-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(NCCCN1CCNCC1)c1ccc2nccn2c1
InChIInChI=1S/C15H21N5O.2ClH/c21-15(13-2-3-14-17-7-11-20(14)12-13)18-4-1-8-19-9-5-16-6-10-19;;/h2-3,7,11-12,16H,1,4-6,8-10H2,(H,18,21);2*1H
InChIKeyLKELEIMWNDHJCU-UHFFFAOYSA-N
XLogP1.20
TPSA61.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.29
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-piperazin-1-ylpropyl)-4-pyrazol-1-ylbenzamide
CID 119391850
N-[2-(cycloheptylamino)ethyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 119619984
4-(1,2,4-oxadiazol-3-yl)-N-(3-piperazin-1-ylpropyl)benzamide;hydrochloride
CID 119393528
N-(3-piperazin-1-ylpropyl)-4-(trifluoromethyl)benzamide;hydrochloride
CID 119391119
N-[(4-piperazin-1-ylsulfinylphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 123570000
N-(3-piperazin-1-ylpropyl)-6-(trifluoromethyl)pyridine-3-carboxamide;dihydrochloride
CID 119393326
4-(1,2,4-oxadiazol-3-yl)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119393529
4-methylsulfanyl-N-(3-piperazin-1-ylpropyl)benzamide;hydrochloride
CID 119390747
3-hydroxy-4-methyl-N-(3-piperazin-1-ylpropyl)benzamide
CID 43443390
4-(difluoromethylsulfanyl)-N-(3-piperazin-1-ylpropyl)benzamide;hydrochloride
CID 119392818
N-(3-methylbutyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110704020
6-(dimethylamino)-N-(3-piperazin-1-ylpropyl)pyridine-3-carboxamide
CID 119392462

Frequently Asked Questions

What is the IUPAC name of N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
The IUPAC name of N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride (CID 119392015) is N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride.
What is the SMILES notation for N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
The canonical SMILES for N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride is Cl.Cl.O=C(NCCCN1CCNCC1)c1ccc2nccn2c1.
What is the InChIKey of N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
The InChIKey is LKELEIMWNDHJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O.2ClH/c21-15(13-2-3-14-17-7-11-20(14)12-13)18-4-1-8-19-9-5-16-6-10-19;;/h2-3,7,11-12,16H,1,4-6,8-10H2,(H,18,21);2*1H.
What are the key properties of N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride?
N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride has a molecular weight of 360.29 g/mol, XLogP of 1.20, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-piperazin-1-ylpropyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride is sourced from PubChem (CID 119392015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).