1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride

C12H21ClN4O — CID 75511870

IUPAC1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)n1cc(NC(=O)C2(N)CCCC2)cn1.Cl
InChIInChI=1S/C12H20N4O.ClH/c1-9(2)16-8-10(7-14-16)15-11(17)12(13)5-3-4-6-12;/h7-9H,3-6,13H2,1-2H3,(H,15,17);1H
InChIKeyNFYYZAGQZYZHLV-UHFFFAOYSA-N
MW272.78 g/mol
LogP2.10
Rot. Bonds3

About 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride

1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 75511870) has the molecular formula C12H21ClN4O and a molecular weight of 272.78 g/mol. Its IUPAC name is 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID75511870
Molecular FormulaC12H21ClN4O
Molecular Weight272.78 g/mol
Exact Mass272.14
IUPAC Name1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)n1cc(NC(=O)C2(N)CCCC2)cn1.Cl
InChIInChI=1S/C12H20N4O.ClH/c1-9(2)16-8-10(7-14-16)15-11(17)12(13)5-3-4-6-12;/h7-9H,3-6,13H2,1-2H3,(H,15,17);1H
InChIKeyNFYYZAGQZYZHLV-UHFFFAOYSA-N
XLogP2.10
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.78
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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1-[(1-propan-2-ylpyrazol-4-yl)carbamoylamino]cyclopentane-1-carboxylic acid
CID 62904289
2-[1-(aminomethyl)cyclobutyl]-N-(1-propan-2-ylpyrazol-4-yl)acetamide
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ethyl 2-[4-[(1-aminocyclohexanecarbonyl)amino]pyrazol-1-yl]-2-methylpropanoate;hydrochloride
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N-(1-propan-2-ylpyrazol-4-yl)azepane-1-carboxamide
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1-amino-N-[1-(1-methylpyrazol-4-yl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119322404
4,4-dimethyl-N-(1-propan-2-ylpyrazol-4-yl)azepane-1-carboxamide
CID 71981500
1-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 60945429

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride (CID 75511870) is 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride is CC(C)n1cc(NC(=O)C2(N)CCCC2)cn1.Cl.
What is the InChIKey of 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is NFYYZAGQZYZHLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O.ClH/c1-9(2)16-8-10(7-14-16)15-11(17)12(13)5-3-4-6-12;/h7-9H,3-6,13H2,1-2H3,(H,15,17);1H.
What are the key properties of 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 272.78 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(1-propan-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 75511870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).