5-(4-amino-5-methylpyrazol-1-yl)pentanamide

C9H16N4O — CID 165471809

IUPAC5-(4-amino-5-methylpyrazol-1-yl)pentanamide
SMILESCc1c(N)cnn1CCCCC(N)=O
InChIInChI=1S/C9H16N4O/c1-7-8(10)6-12-13(7)5-3-2-4-9(11)14/h6H,2-5,10H2,1H3,(H2,11,14)
InChIKeyIRGBYDHCTPXKNI-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.43
Rot. Bonds5

About 5-(4-amino-5-methylpyrazol-1-yl)pentanamide

5-(4-amino-5-methylpyrazol-1-yl)pentanamide (PubChem CID 165471809) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 5-(4-amino-5-methylpyrazol-1-yl)pentanamide.

Molecular Properties

Compound Name5-(4-amino-5-methylpyrazol-1-yl)pentanamide
PubChem CID165471809
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name5-(4-amino-5-methylpyrazol-1-yl)pentanamide
SMILESCc1c(N)cnn1CCCCC(N)=O
InChIInChI=1S/C9H16N4O/c1-7-8(10)6-12-13(7)5-3-2-4-9(11)14/h6H,2-5,10H2,1H3,(H2,11,14)
InChIKeyIRGBYDHCTPXKNI-UHFFFAOYSA-N
XLogP0.43
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(4,5-diaminopyrazol-1-yl)butanamide
CID 58913950
5-(4-chloro-5-methylpyrazol-1-yl)-N'-hydroxypentanimidamide
CID 77037656
1-(2-ethoxyethyl)-5-methylpyrazol-4-amine
CID 165473067
1-[(E)-but-2-enyl]-5-methylpyrazol-4-amine
CID 131351802
3-[2-(4-amino-5-methylpyrazol-1-yl)ethyl]-1,3-thiazol-2-one
CID 165473542
1-(3-fluoropropyl)-5-methylpyrazole-4-carboxylic acid
CID 81113615
5-[(4-amino-5-methyl-2-pyridinyl)amino]pentanamide
CID 106234120
5-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]pentanamide
CID 114281817
5-methyl-1-(3,3,3-trifluoropropyl)pyrazole-4-carboxamide
CID 175848661
5-methyl-1-[2-(1-methylpyrazol-3-yl)ethyl]pyrazol-4-amine
CID 90010529
4-amino-N-[3-(4-chloro-5-methylpyrazol-1-yl)propyl]-1-methylpyrazole-3-carboxamide
CID 19620405
1-(2-cyclopentyloxyethyl)-5-methylpyrazol-4-amine
CID 165480190

Frequently Asked Questions

What is the IUPAC name of 5-(4-amino-5-methylpyrazol-1-yl)pentanamide?
The IUPAC name of 5-(4-amino-5-methylpyrazol-1-yl)pentanamide (CID 165471809) is 5-(4-amino-5-methylpyrazol-1-yl)pentanamide.
What is the SMILES notation for 5-(4-amino-5-methylpyrazol-1-yl)pentanamide?
The canonical SMILES for 5-(4-amino-5-methylpyrazol-1-yl)pentanamide is Cc1c(N)cnn1CCCCC(N)=O.
What is the InChIKey of 5-(4-amino-5-methylpyrazol-1-yl)pentanamide?
The InChIKey is IRGBYDHCTPXKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-7-8(10)6-12-13(7)5-3-2-4-9(11)14/h6H,2-5,10H2,1H3,(H2,11,14).
What are the key properties of 5-(4-amino-5-methylpyrazol-1-yl)pentanamide?
5-(4-amino-5-methylpyrazol-1-yl)pentanamide has a molecular weight of 196.25 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-amino-5-methylpyrazol-1-yl)pentanamide is sourced from PubChem (CID 165471809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).