N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide

C12H19N3O — CID 104619647

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide
SMILESCCc1cc(NC(=O)C2(C)CCCC2)n[nH]1
InChIInChI=1S/C12H19N3O/c1-3-9-8-10(15-14-9)13-11(16)12(2)6-4-5-7-12/h8H,3-7H2,1-2H3,(H2,13,14,15,16)
InChIKeyAHXQQMUDFXYLJN-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.49
Rot. Bonds3

About N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide

N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide (PubChem CID 104619647) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide
PubChem CID104619647
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide
SMILESCCc1cc(NC(=O)C2(C)CCCC2)n[nH]1
InChIInChI=1S/C12H19N3O/c1-3-9-8-10(15-14-9)13-11(16)12(2)6-4-5-7-12/h8H,3-7H2,1-2H3,(H2,13,14,15,16)
InChIKeyAHXQQMUDFXYLJN-UHFFFAOYSA-N
XLogP2.49
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-ethyl-1H-pyrazol-3-yl)-4-methylpiperidine-4-carboxamide
CID 104618097
1-(4-bromophenyl)-N-(5-ethyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide
CID 115609339
(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406
1-N,4-N-bis(5-propyl-1H-pyrazol-3-yl)bicyclo[2.2.2]octane-1,4-dicarboxamide
CID 166234540
2-cyclopentyl-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 115593738
2-(2,3-dihydro-1H-inden-5-yl)-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 115593756
3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide
CID 113433541
N-(5-ethyl-1H-pyrazol-3-yl)cyclopent-3-ene-1-carboxamide
CID 115644958
N-(4-ethyl-1H-pyrazol-5-yl)-1-methylcyclohexane-1-carboxamide
CID 106827945
1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
CID 63820608
1-ethyl-3-(5-ethyl-1H-pyrazol-3-yl)-1-methylurea
CID 104620385
2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
CID 104618255

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide (CID 104619647) is N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide is CCc1cc(NC(=O)C2(C)CCCC2)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide?
The InChIKey is AHXQQMUDFXYLJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-9-8-10(15-14-9)13-11(16)12(2)6-4-5-7-12/h8H,3-7H2,1-2H3,(H2,13,14,15,16).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide?
N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 104619647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).