3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide

C16H20N4O — CID 119822942

IUPAC3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide
SMILESCc1ccccc1-n1nccc1NC(=O)C1CCC(N)C1
InChIInChI=1S/C16H20N4O/c1-11-4-2-3-5-14(11)20-15(8-9-18-20)19-16(21)12-6-7-13(17)10-12/h2-5,8-9,12-13H,6-7,10,17H2,1H3,(H,19,21)
InChIKeyJZTQUCCFSFJBDL-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.25
Rot. Bonds3

About 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide

3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide (PubChem CID 119822942) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide
PubChem CID119822942
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide
SMILESCc1ccccc1-n1nccc1NC(=O)C1CCC(N)C1
InChIInChI=1S/C16H20N4O/c1-11-4-2-3-5-14(11)20-15(8-9-18-20)19-16(21)12-6-7-13(17)10-12/h2-5,8-9,12-13H,6-7,10,17H2,1H3,(H,19,21)
InChIKeyJZTQUCCFSFJBDL-UHFFFAOYSA-N
XLogP2.25
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclohexane-1-carboxamide
CID 119822944
(3R)-3-N-[2-(2-methylphenyl)pyrazol-3-yl]piperidine-1,3-dicarboxamide
CID 96540089
N-[2-(2-methylphenyl)pyrazol-3-yl]piperidine-3-carboxamide;hydrochloride
CID 119346019
N-[2-[[2-(2-methylphenyl)pyrazol-3-yl]carbamoylamino]ethyl]cyclopropanecarboxamide
CID 84598089
3-amino-N-(2-propan-2-ylpyrazol-3-yl)cyclopentane-1-carboxamide
CID 66031864
cis-(1R,2S)-N-[2-(2-methylphenyl)pyrazol-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide
CID 96539720
3-amino-N-(2-pyrazol-1-ylphenyl)cyclopentane-1-carboxamide
CID 66010182
2-(hydroxymethyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]pyrrolidine-1-carboxamide
CID 75442974
(2R)-N-[2-(2-methylphenyl)pyrazol-3-yl]-2-methylsulfanylpropanamide
CID 96539727
3-amino-N-[2-[(2,3-dichlorophenyl)methyl]pyrazol-3-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119696113
(3S)-3-amino-N-[4-[(2-methylphenyl)carbamoylamino]phenyl]cyclopentane-1-carboxamide
CID 70107812
3-amino-N-(2-benzyl-5-methylpyrazol-3-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119704830

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide (CID 119822942) is 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide is Cc1ccccc1-n1nccc1NC(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide?
The InChIKey is JZTQUCCFSFJBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-11-4-2-3-5-14(11)20-15(8-9-18-20)19-16(21)12-6-7-13(17)10-12/h2-5,8-9,12-13H,6-7,10,17H2,1H3,(H,19,21).
What are the key properties of 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide?
3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(2-methylphenyl)pyrazol-3-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119822942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).