2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide

C13H22N4O — CID 104618255

IUPAC2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
SMILESCCCc1cc(NC(=O)C2(C)CCCC2N)n[nH]1
InChIInChI=1S/C13H22N4O/c1-3-5-9-8-11(17-16-9)15-12(18)13(2)7-4-6-10(13)14/h8,10H,3-7,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyMGYAFRQLDZSGLJ-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.82
Rot. Bonds4

About 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide

2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide (PubChem CID 104618255) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
PubChem CID104618255
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
SMILESCCCc1cc(NC(=O)C2(C)CCCC2N)n[nH]1
InChIInChI=1S/C13H22N4O/c1-3-5-9-8-11(17-16-9)15-12(18)13(2)7-4-6-10(13)14/h8,10H,3-7,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyMGYAFRQLDZSGLJ-UHFFFAOYSA-N
XLogP1.82
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-bis(5-propyl-1H-pyrazol-3-yl)bicyclo[2.2.2]octane-1,4-dicarboxamide
CID 166234540
N-(5-propyl-1H-pyrazol-3-yl)cyclopropanecarboxamide
CID 115619791
3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide
CID 113433541
2-(1-aminocyclopentyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 113433565
6-amino-7,7-dimethyl-N-(5-propyl-1H-pyrazol-3-yl)-2-oxabicyclo[3.2.0]heptane-6-carboxamide
CID 114946605
2-(cyclopentylamino)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 113433550
2-amino-1-methyl-N-(2-propylphenyl)cyclopentane-1-carboxamide
CID 82764407
2-(1-hydroxycyclohexyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 111538367
1,1-dimethyl-3-(5-propyl-1H-pyrazol-3-yl)urea
CID 115621073
2-amino-N-(6-chloro-2-pyridinyl)-1-methylcyclopentane-1-carboxamide
CID 82767561
1-[2-oxo-2-[(5-propyl-1H-pyrazol-3-yl)amino]ethyl]cyclopentane-1-carboxylic acid
CID 104617311
N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
CID 115976378

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide (CID 104618255) is 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide is CCCc1cc(NC(=O)C2(C)CCCC2N)n[nH]1.
What is the InChIKey of 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide?
The InChIKey is MGYAFRQLDZSGLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-3-5-9-8-11(17-16-9)15-12(18)13(2)7-4-6-10(13)14/h8,10H,3-7,14H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide?
2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.82, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 104618255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).