6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide

C24H26N2O3S — CID 25010416

IUPAC6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide
SMILESCc1cc([C@@H](C)NC(=O)c2ccc3cc(C4CC4)ccc3c2)ccc1NS(C)(=O)=O
InChIInChI=1S/C24H26N2O3S/c1-15-12-18(10-11-23(15)26-30(3,28)29)16(2)25-24(27)22-9-8-20-13-19(17-4-5-17)6-7-21(20)14-22/h6-14,16-17,26H,4-5H2,1-3H3,(H,25,27)/t16-/m1/s1
InChIKeyADHYDHDYCHAVHX-MRXNPFEDSA-N
MW422.55 g/mol
LogP4.89
Rot. Bonds6

About 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide

6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide (PubChem CID 25010416) has the molecular formula C24H26N2O3S and a molecular weight of 422.55 g/mol. Its IUPAC name is 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide
PubChem CID25010416
Molecular FormulaC24H26N2O3S
Molecular Weight422.55 g/mol
Exact Mass422.17
IUPAC Name6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide
SMILESCc1cc([C@@H](C)NC(=O)c2ccc3cc(C4CC4)ccc3c2)ccc1NS(C)(=O)=O
InChIInChI=1S/C24H26N2O3S/c1-15-12-18(10-11-23(15)26-30(3,28)29)16(2)25-24(27)22-9-8-20-13-19(17-4-5-17)6-7-21(20)14-22/h6-14,16-17,26H,4-5H2,1-3H3,(H,25,27)/t16-/m1/s1
InChIKeyADHYDHDYCHAVHX-MRXNPFEDSA-N
XLogP4.89
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.55
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide (CID 25010416) is 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide is Cc1cc([C@@H](C)NC(=O)c2ccc3cc(C4CC4)ccc3c2)ccc1NS(C)(=O)=O.
What is the InChIKey of 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide?
The InChIKey is ADHYDHDYCHAVHX-MRXNPFEDSA-N. The full InChI is InChI=1S/C24H26N2O3S/c1-15-12-18(10-11-23(15)26-30(3,28)29)16(2)25-24(27)22-9-8-20-13-19(17-4-5-17)6-7-21(20)14-22/h6-14,16-17,26H,4-5H2,1-3H3,(H,25,27)/t16-/m1/s1.
What are the key properties of 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide?
6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide has a molecular weight of 422.55 g/mol, XLogP of 4.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]naphthalene-2-carboxamide is sourced from PubChem (CID 25010416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).