N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride

C14H19ClN4O2 — CID 119603692

IUPACN-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride
SMILESCl.NCC1CCCC1NC(=O)c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C14H18N4O2.ClH/c15-8-9-3-1-4-10(9)16-14(19)12-7-11(17-18-12)13-5-2-6-20-13;/h2,5-7,9-10H,1,3-4,8,15H2,(H,16,19)(H,17,18);1H
InChIKeyXXJFYZZVQIZHRW-UHFFFAOYSA-N
MW310.79 g/mol
LogP1.95
Rot. Bonds4

About N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride

N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride (PubChem CID 119603692) has the molecular formula C14H19ClN4O2 and a molecular weight of 310.79 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride
PubChem CID119603692
Molecular FormulaC14H19ClN4O2
Molecular Weight310.79 g/mol
Exact Mass310.12
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride
SMILESCl.NCC1CCCC1NC(=O)c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C14H18N4O2.ClH/c15-8-9-3-1-4-10(9)16-14(19)12-7-11(17-18-12)13-5-2-6-20-13;/h2,5-7,9-10H,1,3-4,8,15H2,(H,16,19)(H,17,18);1H
InChIKeyXXJFYZZVQIZHRW-UHFFFAOYSA-N
XLogP1.95
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.79
LogP ≤ 51.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 119605177
N-[2-(aminomethyl)cyclopentyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide;hydrochloride
CID 119600794
N-[2-(aminomethyl)cyclopentyl]-2-(furan-2-yl)-1,3-thiazole-5-carboxamide
CID 119602827
N-[[(1S,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 99732094
N-[2-(aminomethyl)cyclohexyl]-1,2-oxazole-3-carboxamide;hydrochloride
CID 119609735
N-[2-(aminomethyl)cyclohexyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119610162
5-(furan-2-yl)-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyrazole-3-carboxamide
CID 90633194
N-tert-butyl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 6626158
N-butan-2-yl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 19513917
N-[2-(aminomethyl)cyclopentyl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide;hydrochloride
CID 119600626
5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide
CID 95985082
5-(furan-2-yl)-N-(3-hydroxypropyl)-1H-pyrazole-3-carboxamide
CID 78854308

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride (CID 119603692) is N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride is Cl.NCC1CCCC1NC(=O)c1cc(-c2ccco2)[nH]n1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride?
The InChIKey is XXJFYZZVQIZHRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2.ClH/c15-8-9-3-1-4-10(9)16-14(19)12-7-11(17-18-12)13-5-2-6-20-13;/h2,5-7,9-10H,1,3-4,8,15H2,(H,16,19)(H,17,18);1H.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride?
N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride has a molecular weight of 310.79 g/mol, XLogP of 1.95, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride is sourced from PubChem (CID 119603692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).