3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide

C11H18N4O — CID 64523051

IUPAC3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide
SMILESNc1cc(C(=O)NCCC2CCCC2)[nH]n1
InChIInChI=1S/C11H18N4O/c12-10-7-9(14-15-10)11(16)13-6-5-8-3-1-2-4-8/h7-8H,1-6H2,(H,13,16)(H3,12,14,15)
InChIKeyBVQBMZQBAKONJP-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.30
Rot. Bonds4

About 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide

3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide (PubChem CID 64523051) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide
PubChem CID64523051
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide
SMILESNc1cc(C(=O)NCCC2CCCC2)[nH]n1
InChIInChI=1S/C11H18N4O/c12-10-7-9(14-15-10)11(16)13-6-5-8-3-1-2-4-8/h7-8H,1-6H2,(H,13,16)(H3,12,14,15)
InChIKeyBVQBMZQBAKONJP-UHFFFAOYSA-N
XLogP1.30
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-(2-cyclopentylethyl)-1H-pyrazole-4-carboxamide
CID 60920304
5-amino-N-(2-cyclohexylethyl)-1H-pyrazole-4-carboxamide
CID 54932334
3-amino-N-[3-[cyclohexyl(methyl)amino]propyl]-1H-pyrazole-5-carboxamide
CID 64524298
3-amino-N-(4-propylcyclohexyl)-1H-pyrazole-5-carboxamide
CID 64524883
3-amino-N-pentyl-1H-pyrazole-5-carboxamide
CID 64525391
3-amino-N-(4-hydroxybutyl)-1H-pyrazole-5-carboxamide
CID 106840125
2-amino-N-(2-cyclopentylethyl)pyridine-4-carboxamide
CID 62161813
3-amino-N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-1H-pyrazole-5-carboxamide
CID 125157238
3-amino-N-(5-amino-5-oxopentyl)-1H-pyrazole-5-carboxamide
CID 106233227
3,5-diamino-N-(2-cyclohexylethyl)benzamide
CID 61103497
2-amino-6-chloro-N-(2-cyclopentylethyl)pyridine-4-carboxamide
CID 55041983
3-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]-1H-pyrazole-5-carboxamide
CID 64523251

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide (CID 64523051) is 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide is Nc1cc(C(=O)NCCC2CCCC2)[nH]n1.
What is the InChIKey of 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide?
The InChIKey is BVQBMZQBAKONJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c12-10-7-9(14-15-10)11(16)13-6-5-8-3-1-2-4-8/h7-8H,1-6H2,(H,13,16)(H3,12,14,15).
What are the key properties of 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide?
3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-cyclopentylethyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 64523051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).