N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide

C17H26N2OS — CID 62832690

IUPACN-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)Nc1ccccc1SC1CCCC1
InChIInChI=1S/C17H26N2OS/c1-4-18-17(2,3)16(20)19-14-11-7-8-12-15(14)21-13-9-5-6-10-13/h7-8,11-13,18H,4-6,9-10H2,1-3H3,(H,19,20)
InChIKeyKSCVWKGMSMWSFN-UHFFFAOYSA-N
MW306.47 g/mol
LogP4.05
Rot. Bonds6

About N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide

N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide (PubChem CID 62832690) has the molecular formula C17H26N2OS and a molecular weight of 306.47 g/mol. Its IUPAC name is N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide
PubChem CID62832690
Molecular FormulaC17H26N2OS
Molecular Weight306.47 g/mol
Exact Mass306.18
IUPAC NameN-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)Nc1ccccc1SC1CCCC1
InChIInChI=1S/C17H26N2OS/c1-4-18-17(2,3)16(20)19-14-11-7-8-12-15(14)21-13-9-5-6-10-13/h7-8,11-13,18H,4-6,9-10H2,1-3H3,(H,19,20)
InChIKeyKSCVWKGMSMWSFN-UHFFFAOYSA-N
XLogP4.05
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.47
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide 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-(2-cyclopentylsulfanylphenyl)-2-methyl-2-(methylamino)propanamide
CID 62835848
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-(ethylamino)-2-methylpropanamide
CID 62832519
2-amino-N-(2-cyclopentylsulfanylphenyl)-3-methoxypropanamide
CID 81083432
N-(2-cyclopentylsulfanylphenyl)-2-(propan-2-ylamino)acetamide
CID 60843241
2,2,2-trifluoroethyl N-(2-cyclopentylsulfanylphenyl)carbamate
CID 65173873
N-(2-cyclopentylsulfanylphenyl)cyclobutanecarboxamide
CID 32562041
2-amino-N-(2-cyclopentylsulfanylphenyl)-3-methylpentanamide
CID 43696805
N-(2-cyclopentylsulfanylphenyl)-2-methylsulfanylpropanamide
CID 47327417
N-(2-cyclopentylsulfanylphenyl)-2-(methylamino)propanamide
CID 55096699
2-(aminomethyl)-N-(2-cyclopentylsulfanylphenyl)pentanamide
CID 65225963
N-(2-cyclopentylsulfanylphenyl)-4-(methylamino)butanamide
CID 60841702
N-[2-[(dimethylamino)methyl]phenyl]-2-(ethylamino)-2-methylpropanamide
CID 62832687

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide?
The IUPAC name of N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide (CID 62832690) is N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide.
What is the SMILES notation for N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide?
The canonical SMILES for N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide is CCNC(C)(C)C(=O)Nc1ccccc1SC1CCCC1.
What is the InChIKey of N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide?
The InChIKey is KSCVWKGMSMWSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2OS/c1-4-18-17(2,3)16(20)19-14-11-7-8-12-15(14)21-13-9-5-6-10-13/h7-8,11-13,18H,4-6,9-10H2,1-3H3,(H,19,20).
What are the key properties of N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide?
N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide has a molecular weight of 306.47 g/mol, XLogP of 4.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylsulfanylphenyl)-2-(ethylamino)-2-methylpropanamide is sourced from PubChem (CID 62832690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).