(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide

C19H23NOS — CID 7402929

IUPAC(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide
SMILESC[C@@H](Sc1ccc2ccccc2c1)C(=O)NC1CCCCC1
InChIInChI=1S/C19H23NOS/c1-14(19(21)20-17-9-3-2-4-10-17)22-18-12-11-15-7-5-6-8-16(15)13-18/h5-8,11-14,17H,2-4,9-10H2,1H3,(H,20,21)/t14-/m1/s1
InChIKeyGRIUUNCGZMJKIG-CQSZACIVSA-N
MW313.47 g/mol
LogP4.77
Rot. Bonds4

About (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide

(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide (PubChem CID 7402929) has the molecular formula C19H23NOS and a molecular weight of 313.47 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide
PubChem CID7402929
Molecular FormulaC19H23NOS
Molecular Weight313.47 g/mol
Exact Mass313.15
IUPAC Name(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide
SMILESC[C@@H](Sc1ccc2ccccc2c1)C(=O)NC1CCCCC1
InChIInChI=1S/C19H23NOS/c1-14(19(21)20-17-9-3-2-4-10-17)22-18-12-11-15-7-5-6-8-16(15)13-18/h5-8,11-14,17H,2-4,9-10H2,1H3,(H,20,21)/t14-/m1/s1
InChIKeyGRIUUNCGZMJKIG-CQSZACIVSA-N
XLogP4.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.47
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-(4-hydroxyphenyl)sulfanylpropanamide
CID 47262934
N-cyclopentyl-2-[3-(1-hydroxyethyl)phenyl]sulfanylpropanamide
CID 64665320
2-(4-amino-3-fluorophenyl)sulfanyl-N-cyclopentylpropanamide
CID 79141100
2-[3-(aminomethyl)phenyl]sulfanyl-N-cyclopentylpropanamide
CID 66354315
(2S)-2-(4-acetamidophenyl)sulfanyl-N-cyclopentylpropanamide
CID 2423355
(2S)-N-carbamoyl-2-naphthalen-2-ylsulfanylpropanamide
CID 2500778
N-cyclopentyl-2-[3-(ethylaminomethyl)phenyl]sulfanylpropanamide
CID 66349004
(2R)-N-cyclopropyl-2-(3-methoxyphenyl)sulfanylpropanamide
CID 35041164
(2R)-N-(cyclopentylcarbamoyl)-2-(3,4-dimethylphenyl)sulfanylpropanamide
CID 8736919
(2S)-N-cyclopentyl-2-(2-methoxyphenyl)sulfanylpropanamide
CID 94214627
(2R)-N-benzyl-2-naphthalen-2-ylsulfanylpropanamide
CID 7793117
(2R)-N-cyclohexyl-2-(3-ethyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylpropanamide
CID 8674952

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide?
The IUPAC name of (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide (CID 7402929) is (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide.
What is the SMILES notation for (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide?
The canonical SMILES for (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide is C[C@@H](Sc1ccc2ccccc2c1)C(=O)NC1CCCCC1.
What is the InChIKey of (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide?
The InChIKey is GRIUUNCGZMJKIG-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23NOS/c1-14(19(21)20-17-9-3-2-4-10-17)22-18-12-11-15-7-5-6-8-16(15)13-18/h5-8,11-14,17H,2-4,9-10H2,1H3,(H,20,21)/t14-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide?
(2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide has a molecular weight of 313.47 g/mol, XLogP of 4.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-2-naphthalen-2-ylsulfanylpropanamide is sourced from PubChem (CID 7402929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).