N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide

C18H21N3O — CID 71874447

IUPACN-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccccc1C1CC1C(=O)Nc1n[nH]c(C2CC2)c1C
InChIInChI=1S/C18H21N3O/c1-10-5-3-4-6-13(10)14-9-15(14)18(22)19-17-11(2)16(20-21-17)12-7-8-12/h3-6,12,14-15H,7-9H2,1-2H3,(H2,19,20,21,22)
InChIKeyVGTQUBDMRFALBI-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.65
Rot. Bonds4

About N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide

N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide (PubChem CID 71874447) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide
PubChem CID71874447
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC NameN-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccccc1C1CC1C(=O)Nc1n[nH]c(C2CC2)c1C
InChIInChI=1S/C18H21N3O/c1-10-5-3-4-6-13(10)14-9-15(14)18(22)19-17-11(2)16(20-21-17)12-7-8-12/h3-6,12,14-15H,7-9H2,1-2H3,(H2,19,20,21,22)
InChIKeyVGTQUBDMRFALBI-UHFFFAOYSA-N
XLogP3.65
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
CID 119453095
N-(5-amino-2-methylphenyl)-2-(2-methylphenyl)cyclopropane-1-carboxamide
CID 120569043
trans-(1S,2S)-2-(2-methylphenyl)-N-[3-(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)propyl]cyclopropane-1-carboxamide
CID 136807910
2-cyclopropyl-2-[[2-(2-methylphenyl)cyclopropanecarbonyl]amino]propanoic acid
CID 75483394
N-(2-aminoethyl)-2-[[2-(2-methylphenyl)cyclopropanecarbonyl]amino]benzamide
CID 120603302
3-[[2-(2-methylphenyl)cyclopropanecarbonyl]amino]butanoic acid
CID 119221223
2-[[2-(2-methylphenyl)cyclopropanecarbonyl]amino]propanoic acid
CID 119225504
trans-(1R,2R)-N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 167772729
N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 71920970
2-[3-[[(1S,2S)-2-(2-methylphenyl)cyclopropanecarbonyl]amino]pyrazol-1-yl]acetic acid
CID 129380619
N-[2-(methylamino)ethyl]-2-(2-methylphenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119503238
trans-(1R,2R)-2-(2-methylphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 167824410

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide (CID 71874447) is N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide is Cc1ccccc1C1CC1C(=O)Nc1n[nH]c(C2CC2)c1C.
What is the InChIKey of N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide?
The InChIKey is VGTQUBDMRFALBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-10-5-3-4-6-13(10)14-9-15(14)18(22)19-17-11(2)16(20-21-17)12-7-8-12/h3-6,12,14-15H,7-9H2,1-2H3,(H2,19,20,21,22).
What are the key properties of N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide?
N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide has a molecular weight of 295.39 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-4-methyl-1H-pyrazol-3-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 71874447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).