N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide

C22H26N2O2 — CID 60586858

IUPACN-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide
SMILESCC(C)c1cccc(N(C)C(=O)c2ccc(NC(=O)C3CC3C)cc2)c1
InChIInChI=1S/C22H26N2O2/c1-14(2)17-6-5-7-19(13-17)24(4)22(26)16-8-10-18(11-9-16)23-21(25)20-12-15(20)3/h5-11,13-15,20H,12H2,1-4H3,(H,23,25)
InChIKeyLDJWXKOUCQIOKO-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.68
Rot. Bonds5

About N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide

N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide (PubChem CID 60586858) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide
PubChem CID60586858
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide
SMILESCC(C)c1cccc(N(C)C(=O)c2ccc(NC(=O)C3CC3C)cc2)c1
InChIInChI=1S/C22H26N2O2/c1-14(2)17-6-5-7-19(13-17)24(4)22(26)16-8-10-18(11-9-16)23-21(25)20-12-15(20)3/h5-11,13-15,20H,12H2,1-4H3,(H,23,25)
InChIKeyLDJWXKOUCQIOKO-UHFFFAOYSA-N
XLogP4.68
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 2970022
2-[methyl-[4-[(2-methylcyclopropanecarbonyl)amino]benzoyl]amino]acetic acid
CID 119136419
4-chloro-N-methyl-3-[[(1R,2R)-2-methylcyclopropanecarbonyl]amino]-N-phenylbenzamide
CID 95773774
N-[4-(1-hydroxyethyl)phenyl]-2-methylcyclopropane-1-carboxamide
CID 43508348
methyl 4-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]benzoate
CID 7741315
(1R,6R)-6-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate
CID 6977837
(1S,6S)-6-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate
CID 6977834
N-[4-(1-aminoethyl)phenyl]-2-methylcyclopropane-1-carboxamide
CID 16794453
trans-(1R,2R)-N-(3-acetylphenyl)-2-methylcyclopropane-1-carboxamide
CID 2111342
1-N-(3-methylphenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141020
2-[methyl-[3-[(2-methylcyclopropanecarbonyl)amino]benzoyl]amino]acetic acid
CID 119136391
N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 46431000

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide?
The IUPAC name of N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide (CID 60586858) is N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide.
What is the SMILES notation for N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide?
The canonical SMILES for N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide is CC(C)c1cccc(N(C)C(=O)c2ccc(NC(=O)C3CC3C)cc2)c1.
What is the InChIKey of N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide?
The InChIKey is LDJWXKOUCQIOKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-14(2)17-6-5-7-19(13-17)24(4)22(26)16-8-10-18(11-9-16)23-21(25)20-12-15(20)3/h5-11,13-15,20H,12H2,1-4H3,(H,23,25).
What are the key properties of N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide?
N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]-N-(3-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 60586858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).