N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide

C23H24N2O2 — CID 60533340

IUPACN-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide
SMILESCCC(C)(C)NC(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O2/c1-4-23(2,3)25-21(26)17-12-14-18(15-13-17)24-22(27)20-11-7-9-16-8-5-6-10-19(16)20/h5-15H,4H2,1-3H3,(H,24,27)(H,25,26)
InChIKeyDJIOSDHJVKPJER-UHFFFAOYSA-N
MW360.46 g/mol
LogP5.01
Rot. Bonds5

About N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide

N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide (PubChem CID 60533340) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide
PubChem CID60533340
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC NameN-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide
SMILESCCC(C)(C)NC(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O2/c1-4-23(2,3)25-21(26)17-12-14-18(15-13-17)24-22(27)20-11-7-9-16-8-5-6-10-19(16)20/h5-15H,4H2,1-3H3,(H,24,27)(H,25,26)
InChIKeyDJIOSDHJVKPJER-UHFFFAOYSA-N
XLogP5.01
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-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

N-[4-[(2-methylphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 2988389
4-amino-N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]benzamide
CID 119738238
N-(4-iodophenyl)naphthalene-1-carboxamide
CID 1019200
N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 51189018
4-[(2-aminoacetyl)amino]-N-(2-methylbutan-2-yl)benzamide
CID 119297460
3-(carbamoylamino)-N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]benzamide
CID 99193425
pentyl 4-(naphthalene-1-carbonylamino)benzoate
CID 19203532
3,4,5-trimethoxy-N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]benzamide
CID 55891061
N-(1-amino-2-methylpropan-2-yl)naphthalene-1-carboxamide;hydrochloride
CID 119522938
N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide
CID 55890816
N-[4-(pyrrolidine-1-carbonyl)phenyl]naphthalene-1-carboxamide
CID 2986145
N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 21369028

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide (CID 60533340) is N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide is CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide?
The InChIKey is DJIOSDHJVKPJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-4-23(2,3)25-21(26)17-12-14-18(15-13-17)24-22(27)20-11-7-9-16-8-5-6-10-19(16)20/h5-15H,4H2,1-3H3,(H,24,27)(H,25,26).
What are the key properties of N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide?
N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide has a molecular weight of 360.46 g/mol, XLogP of 5.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 60533340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).