N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide

C22H23N3O2 — CID 47015352

IUPACN-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide
SMILESCOc1ccc(C(NC(=O)c2ccc(-n3nccc3C)cc2)C2CC2)cc1
InChIInChI=1S/C22H23N3O2/c1-15-13-14-23-25(15)19-9-5-18(6-10-19)22(26)24-21(16-3-4-16)17-7-11-20(27-2)12-8-17/h5-14,16,21H,3-4H2,1-2H3,(H,24,26)
InChIKeyYFNRIPVVYRWWEX-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.07
Rot. Bonds6

About N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide

N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide (PubChem CID 47015352) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide
PubChem CID47015352
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide
SMILESCOc1ccc(C(NC(=O)c2ccc(-n3nccc3C)cc2)C2CC2)cc1
InChIInChI=1S/C22H23N3O2/c1-15-13-14-23-25(15)19-9-5-18(6-10-19)22(26)24-21(16-3-4-16)17-7-11-20(27-2)12-8-17/h5-14,16,21H,3-4H2,1-2H3,(H,24,26)
InChIKeyYFNRIPVVYRWWEX-UHFFFAOYSA-N
XLogP4.07
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide 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

N-[(R)-cyclopropyl-(4-methoxyphenyl)methyl]-4-morpholin-4-ylbenzamide
CID 92627391
1-[cyclopropyl-(4-methoxyphenyl)methyl]-3-[3-(5-methylpyrazol-1-yl)phenyl]urea
CID 56554718
N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
CID 46566275
4-[4-[[cyclopropyl-(4-methoxyphenyl)methyl]carbamoyl]phenoxy]benzamide
CID 56545772
N-[2-[[cyclopropyl-(4-methoxyphenyl)methyl]amino]-2-oxoethyl]-4-methoxybenzamide
CID 55461380
N-[(R)-cyclopentyl(phenyl)methyl]-4-methoxybenzamide
CID 978301
N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-difluorobenzamide
CID 46571976
N-[cyclopropyl-(4-methoxyphenyl)methyl]acetamide
CID 60701170
1-cyclopropyl-N-[cyclopropyl-(4-methoxyphenyl)methyl]benzimidazole-5-carboxamide
CID 46976355
4-tert-butyl-N-[2-[[cyclopropyl-(4-methoxyphenyl)methyl]amino]-2-oxoethyl]benzamide
CID 46580126
N-[(R)-cyclopropyl-(4-methoxyphenyl)methyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 38468848
N-[cyclopropyl-(4-methoxyphenyl)methyl]-5-methylthiophene-2-carboxamide
CID 42925486

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide?
The IUPAC name of N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide (CID 47015352) is N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide.
What is the SMILES notation for N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide?
The canonical SMILES for N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide is COc1ccc(C(NC(=O)c2ccc(-n3nccc3C)cc2)C2CC2)cc1.
What is the InChIKey of N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide?
The InChIKey is YFNRIPVVYRWWEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-15-13-14-23-25(15)19-9-5-18(6-10-19)22(26)24-21(16-3-4-16)17-7-11-20(27-2)12-8-17/h5-14,16,21H,3-4H2,1-2H3,(H,24,26).
What are the key properties of N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide?
N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide has a molecular weight of 361.45 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(4-methoxyphenyl)methyl]-4-(5-methylpyrazol-1-yl)benzamide is sourced from PubChem (CID 47015352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).