2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride

C14H19ClN4O — CID 119278205

IUPAC2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccn(-c2ccccc2)n1.Cl
InChIInChI=1S/C14H18N4O.ClH/c1-2-6-12(15)14(19)16-13-9-10-18(17-13)11-7-4-3-5-8-11;/h3-5,7-10,12H,2,6,15H2,1H3,(H,16,17,19);1H
InChIKeyDAZSZWIZSICILL-UHFFFAOYSA-N
MW294.79 g/mol
LogP2.36
Rot. Bonds5

About 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride

2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride (PubChem CID 119278205) has the molecular formula C14H19ClN4O and a molecular weight of 294.79 g/mol. Its IUPAC name is 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride
PubChem CID119278205
Molecular FormulaC14H19ClN4O
Molecular Weight294.79 g/mol
Exact Mass294.12
IUPAC Name2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccn(-c2ccccc2)n1.Cl
InChIInChI=1S/C14H18N4O.ClH/c1-2-6-12(15)14(19)16-13-9-10-18(17-13)11-7-4-3-5-8-11;/h3-5,7-10,12H,2,6,15H2,1H3,(H,16,17,19);1H
InChIKeyDAZSZWIZSICILL-UHFFFAOYSA-N
XLogP2.36
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.79
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-4-methylsulfanyl-N-(1-phenylpyrazol-3-yl)butanamide
CID 119278200
(2S)-2-amino-N-(1-methylpyrazol-3-yl)pentanamide
CID 93313980
2-amino-N-(4-pyrazol-1-ylphenyl)pentanamide
CID 43704133
3-methyl-N-(1-phenylpyrazol-3-yl)butanamide
CID 110470740
2-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]pentanamide;hydrochloride
CID 119314328
2-amino-N-[1-(1-phenyltriazol-4-yl)ethyl]pentanamide;hydrochloride
CID 119345704
(2R)-N-[(2R)-butan-2-yl]-2-[(1-phenylpyrazol-3-yl)carbamoylamino]propanamide
CID 95239242
3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55536355
2-amino-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714225
2-amino-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)pentanamide
CID 119261464
2-amino-N-[[1-(4-methoxyphenyl)pyrazol-3-yl]methyl]pentanamide;hydrochloride
CID 119302653
2-amino-N-[2-oxo-2-(4-pyrazol-1-ylanilino)ethyl]pentanamide;hydrochloride
CID 119314524

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride (CID 119278205) is 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride is CCCC(N)C(=O)Nc1ccn(-c2ccccc2)n1.Cl.
What is the InChIKey of 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride?
The InChIKey is DAZSZWIZSICILL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O.ClH/c1-2-6-12(15)14(19)16-13-9-10-18(17-13)11-7-4-3-5-8-11;/h3-5,7-10,12H,2,6,15H2,1H3,(H,16,17,19);1H.
What are the key properties of 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride?
2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride has a molecular weight of 294.79 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-phenylpyrazol-3-yl)pentanamide;hydrochloride is sourced from PubChem (CID 119278205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).