N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide

C19H25N3O2 — CID 16668235

IUPACN-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCOc1cccc(C2(NC(=O)c3cnn(C(C)C)c3)CCCC2)c1
InChIInChI=1S/C19H25N3O2/c1-14(2)22-13-15(12-20-22)18(23)21-19(9-4-5-10-19)16-7-6-8-17(11-16)24-3/h6-8,11-14H,4-5,9-10H2,1-3H3,(H,21,23)
InChIKeyPQGYOKKFCLBKMX-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.67
Rot. Bonds5

About N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide

N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 16668235) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide
PubChem CID16668235
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCOc1cccc(C2(NC(=O)c3cnn(C(C)C)c3)CCCC2)c1
InChIInChI=1S/C19H25N3O2/c1-14(2)22-13-15(12-20-22)18(23)21-19(9-4-5-10-19)16-7-6-8-17(11-16)24-3/h6-8,11-14H,4-5,9-10H2,1-3H3,(H,21,23)
InChIKeyPQGYOKKFCLBKMX-UHFFFAOYSA-N
XLogP3.67
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-(1-phenylcyclobutyl)benzamide
CID 51273020
N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 16672987
3-[[1-(3-methoxyphenyl)cyclohexyl]amino]-2-methyl-3-oxopropanoic acid
CID 154870795
3,5-difluoro-4-hydroxy-N-[1-(3-methoxyphenyl)cyclopropyl]benzamide
CID 86792000
N,1-di(propan-2-yl)pyrazole-4-carboxamide
CID 177272297
N-[[(3R)-1-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-1-propan-2-ylpyrazole-4-carboxamide
CID 129401216
N-methoxy-1-propan-2-ylpyrazole-4-carboxamide
CID 130683619
4-amino-N-[1-(3-methoxyphenyl)cyclopentyl]butanamide
CID 110460844
(5R)-N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 51498169
N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 16673129
N-[1-(3-methoxyphenyl)cyclopentyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide
CID 16674747
methyl 1-propan-2-ylpyrazole-4-carboxylate
CID 55291716

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide (CID 16668235) is N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide is COc1cccc(C2(NC(=O)c3cnn(C(C)C)c3)CCCC2)c1.
What is the InChIKey of N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is PQGYOKKFCLBKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14(2)22-13-15(12-20-22)18(23)21-19(9-4-5-10-19)16-7-6-8-17(11-16)24-3/h6-8,11-14H,4-5,9-10H2,1-3H3,(H,21,23).
What are the key properties of N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide?
N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methoxyphenyl)cyclopentyl]-1-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 16668235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).