1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide

C20H21N5O — CID 126810443

IUPAC1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide
SMILESCc1ccccc1C1(C(=O)Nc2cnn(-c3ncccn3)c2)CCCC1
InChIInChI=1S/C20H21N5O/c1-15-7-2-3-8-17(15)20(9-4-5-10-20)18(26)24-16-13-23-25(14-16)19-21-11-6-12-22-19/h2-3,6-8,11-14H,4-5,9-10H2,1H3,(H,24,26)
InChIKeyRTXUTYDZLMTPFW-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.42
Rot. Bonds4

About 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide

1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide (PubChem CID 126810443) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide
PubChem CID126810443
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC Name1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide
SMILESCc1ccccc1C1(C(=O)Nc2cnn(-c3ncccn3)c2)CCCC1
InChIInChI=1S/C20H21N5O/c1-15-7-2-3-8-17(15)20(9-4-5-10-20)18(26)24-16-13-23-25(14-16)19-21-11-6-12-22-19/h2-3,6-8,11-14H,4-5,9-10H2,1H3,(H,24,26)
InChIKeyRTXUTYDZLMTPFW-UHFFFAOYSA-N
XLogP3.42
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1-diethyl-3-(1-pyrimidin-2-ylpyrazol-4-yl)urea
CID 71984790
1-[1-(4-methyl-3-pyridinyl)ethyl]-3-(1-pyrimidin-2-ylpyrazol-4-yl)urea
CID 166196323
N-(3-fluoro-4-methylphenyl)-1-(2-methylphenyl)cyclopropane-1-carboxamide
CID 155944841
N-(1-cyanocyclohexyl)-2-[(1-pyrimidin-2-ylpyrazol-4-yl)amino]acetamide
CID 126841344
N-[1-(5-pyrrolidin-1-ylpyrimidin-2-yl)pyrazol-4-yl]pyridine-2-carboxamide
CID 53167977
N-(1-pyrimidin-2-ylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119328811
2-(1-hydroxycyclopentyl)-N-(1-phenylpyrazol-4-yl)acetamide
CID 111432531
2-[3-[[1-(2-methylphenyl)cyclopropanecarbonyl]amino]pyrazol-1-yl]acetic acid
CID 126786946
1-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(1-pyrimidin-2-ylpyrazol-4-yl)urea
CID 95899561
N-(3,4-dimethoxyphenyl)-2-[(1-pyrimidin-2-ylpyrazol-4-yl)amino]acetamide
CID 167766154
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-methyl-3-(1-pyrimidin-2-ylpyrazol-4-yl)urea
CID 71984797
1-[(1S)-1-(4-chlorophenyl)ethyl]-3-(1-pyrimidin-2-ylpyrazol-4-yl)urea
CID 95776857

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide (CID 126810443) is 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide is Cc1ccccc1C1(C(=O)Nc2cnn(-c3ncccn3)c2)CCCC1.
What is the InChIKey of 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide?
The InChIKey is RTXUTYDZLMTPFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O/c1-15-7-2-3-8-17(15)20(9-4-5-10-20)18(26)24-16-13-23-25(14-16)19-21-11-6-12-22-19/h2-3,6-8,11-14H,4-5,9-10H2,1H3,(H,24,26).
What are the key properties of 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide?
1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-N-(1-pyrimidin-2-ylpyrazol-4-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 126810443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).