4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

C15H26N4O — CID 106006372

IUPAC4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCC(C)c1[nH]nc(C(=O)NCCCC2CCCC2)c1N
InChIInChI=1S/C15H26N4O/c1-10(2)13-12(16)14(19-18-13)15(20)17-9-5-8-11-6-3-4-7-11/h10-11H,3-9,16H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyIZFWIPSTZAEWBR-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.82
Rot. Bonds6

About 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 106006372) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
PubChem CID106006372
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCC(C)c1[nH]nc(C(=O)NCCCC2CCCC2)c1N
InChIInChI=1S/C15H26N4O/c1-10(2)13-12(16)14(19-18-13)15(20)17-9-5-8-11-6-3-4-7-11/h10-11H,3-9,16H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyIZFWIPSTZAEWBR-UHFFFAOYSA-N
XLogP2.82
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076068
4-amino-N-[2-(2-methoxyethoxy)ethyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 55033876
4-amino-N-(2-hydroxypropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076723
ethyl 3-[(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)amino]propanoate
CID 55033924
4-amino-N-(2-methoxy-2-methylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 104758271
N-(3-cyclopentylpropyl)-5-ethyl-1H-1,2,4-triazole-3-carboxamide
CID 114137118
N-(3-aminopropyl)-4-methyl-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 110833964
(2S)-2-amino-N-(3-cyclopentylpropyl)propanamide
CID 103795255
4-amino-N-cycloheptyl-N-methyl-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62075731
4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076238
4-amino-N-(1-hydroxy-2-methylpropan-2-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076553
4-amino-5-propan-2-yl-N-(2-pyrazol-1-ylethyl)-1H-pyrazole-3-carboxamide
CID 62077584

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (CID 106006372) is 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is CC(C)c1[nH]nc(C(=O)NCCCC2CCCC2)c1N.
What is the InChIKey of 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is IZFWIPSTZAEWBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-10(2)13-12(16)14(19-18-13)15(20)17-9-5-8-11-6-3-4-7-11/h10-11H,3-9,16H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.82, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-cyclopentylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 106006372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).