1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide

C22H27N5O — CID 48662023

IUPAC1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
SMILESCc1ccccc1-n1nc(C(=O)N(Cc2cnn(C)c2)C(C)C)c2c1CCC2
InChIInChI=1S/C22H27N5O/c1-15(2)26(14-17-12-23-25(4)13-17)22(28)21-18-9-7-11-20(18)27(24-21)19-10-6-5-8-16(19)3/h5-6,8,10,12-13,15H,7,9,11,14H2,1-4H3
InChIKeyYTCHEIYUEUEQRB-UHFFFAOYSA-N
MW377.49 g/mol
LogP3.45
Rot. Bonds5

About 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide

1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide (PubChem CID 48662023) has the molecular formula C22H27N5O and a molecular weight of 377.49 g/mol. Its IUPAC name is 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
PubChem CID48662023
Molecular FormulaC22H27N5O
Molecular Weight377.49 g/mol
Exact Mass377.22
IUPAC Name1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
SMILESCc1ccccc1-n1nc(C(=O)N(Cc2cnn(C)c2)C(C)C)c2c1CCC2
InChIInChI=1S/C22H27N5O/c1-15(2)26(14-17-12-23-25(4)13-17)22(28)21-18-9-7-11-20(18)27(24-21)19-10-6-5-8-16(19)3/h5-6,8,10,12-13,15H,7,9,11,14H2,1-4H3
InChIKeyYTCHEIYUEUEQRB-UHFFFAOYSA-N
XLogP3.45
TPSA55.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-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

2-[[1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]-propan-2-ylamino]acetic acid
CID 119198235
3-[[1-(2-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]-propan-2-ylamino]propanoic acid
CID 119207081
N-[(4-methoxyphenyl)methyl]-N-methyl-1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 48652204
N-(2-hydroxyethyl)-1-(2-methylphenyl)-N-propyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 110907858
N-(3-amino-4-methylpentyl)-N-methyl-1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide;hydrochloride
CID 119660746
N-(3-aminopropyl)-1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide;hydrochloride
CID 119408402
(2R)-3-methyl-2-[[1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]amino]butanoic acid
CID 119368106
6-[[1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]amino]hexanoic acid
CID 119219866
N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 126818881
2,5-dihydropyrrol-1-yl-[1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
CID 126827969
N-[(1-methylpyrazol-4-yl)methyl]-4-oxo-4-phenyl-N-propan-2-ylbutanamide
CID 51090804
3-[[1-(4-ethylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]-propan-2-ylamino]propanoic acid
CID 119207522

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
The IUPAC name of 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide (CID 48662023) is 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide.
What is the SMILES notation for 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
The canonical SMILES for 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide is Cc1ccccc1-n1nc(C(=O)N(Cc2cnn(C)c2)C(C)C)c2c1CCC2.
What is the InChIKey of 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
The InChIKey is YTCHEIYUEUEQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O/c1-15(2)26(14-17-12-23-25(4)13-17)22(28)21-18-9-7-11-20(18)27(24-21)19-10-6-5-8-16(19)3/h5-6,8,10,12-13,15H,7,9,11,14H2,1-4H3.
What are the key properties of 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide has a molecular weight of 377.49 g/mol, XLogP of 3.45, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide is sourced from PubChem (CID 48662023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).