N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide

C17H21N3O2 — CID 134797185

IUPACN-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C2CCCC2)nn1C
InChIInChI=1S/C17H21N3O2/c1-20-16(11-14(19-20)12-7-3-4-8-12)18-17(21)13-9-5-6-10-15(13)22-2/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,18,21)
InChIKeyAETUWRWQQAGDSX-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.34
Rot. Bonds4

About N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide

N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide (PubChem CID 134797185) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide
PubChem CID134797185
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC NameN-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C2CCCC2)nn1C
InChIInChI=1S/C17H21N3O2/c1-20-16(11-14(19-20)12-7-3-4-8-12)18-17(21)13-9-5-6-10-15(13)22-2/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,18,21)
InChIKeyAETUWRWQQAGDSX-UHFFFAOYSA-N
XLogP3.34
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Methyl-6-(2-propoxy-phenyl)-1-propyl-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one
CID 135503803
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methoxybenzamide
CID 5330984
6-(2-Ethoxy-phenyl)-3-methyl-1-propyl-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one
CID 136132276
(2S)-19-[(3S)-3-aminopyrrolidin-1-yl]-2-ethyl-3,7,16-trimethyl-11-oxa-3,16,20,22,23-pentazatetracyclo[19.2.1.05,10.017,22]tetracosa-1(23),5(10),6,8,17,19,21(24)-heptaen-4-one
CID 156020277
N-[1-(4-fluorobenzyl)-3-methyl-1H-pyrazol-5-yl]-3-methoxybenzamide
CID 1509647
4-methoxy-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 2352142
2,3-dimethoxy-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 2353715
N-(1,3-diphenyl-1H-pyrazol-5-yl)-3-methoxybenzamide
CID 11710424
N-[1-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl]-5-methylpyrazol-3-yl]cyclopentanecarboxamide
CID 11963102
1,3-Dimethyl-6-(2-propoxy-phenyl)-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one
CID 135529725
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-4-methoxybenzamide
CID 135753063
6-(4-Amino-2-methoxyphenyl)-3-cyclohexyl-1-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
CID 135948887

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide?
The IUPAC name of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide (CID 134797185) is N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide.
What is the SMILES notation for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide?
The canonical SMILES for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide is COc1ccccc1C(=O)Nc1cc(C2CCCC2)nn1C.
What is the InChIKey of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide?
The InChIKey is AETUWRWQQAGDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-20-16(11-14(19-20)12-7-3-4-8-12)18-17(21)13-9-5-6-10-15(13)22-2/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,18,21).
What are the key properties of N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide?
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide has a molecular weight of 299.37 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methoxybenzamide is sourced from PubChem (CID 134797185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).