(2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine

C15H29NS — CID 63405084

IUPAC(2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine
SMILESCCCC1CCC(CN)C(SC2CCCC2)C1
InChIInChI=1S/C15H29NS/c1-2-5-12-8-9-13(11-16)15(10-12)17-14-6-3-4-7-14/h12-15H,2-11,16H2,1H3
InChIKeyZGWOSBPLYODVLH-UHFFFAOYSA-N
MW255.47 g/mol
LogP4.21
Rot. Bonds5

About (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine

(2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine (PubChem CID 63405084) has the molecular formula C15H29NS and a molecular weight of 255.47 g/mol. Its IUPAC name is (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine
PubChem CID63405084
Molecular FormulaC15H29NS
Molecular Weight255.47 g/mol
Exact Mass255.20
IUPAC Name(2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine
SMILESCCCC1CCC(CN)C(SC2CCCC2)C1
InChIInChI=1S/C15H29NS/c1-2-5-12-8-9-13(11-16)15(10-12)17-14-6-3-4-7-14/h12-15H,2-11,16H2,1H3
InChIKeyZGWOSBPLYODVLH-UHFFFAOYSA-N
XLogP4.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.47
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine 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

(4-propyl-2-propylsulfanylcyclohexyl)methanamine
CID 43530082
2-(aminomethyl)-5-propylcyclohexan-1-amine
CID 62070306
(2-phenylsulfanyl-4-propylcyclohexyl)methanamine
CID 43530144
[2-(4-methylphenyl)sulfanyl-4-propylcyclohexyl]methanamine
CID 43530264
[2-(5-methylpyrimidin-2-yl)sulfanyl-4-propylcyclohexyl]methanamine
CID 61382815
[2-(2-methylphenyl)sulfanyl-4-propylcyclohexyl]methanamine
CID 63404568
(3-propylcyclopentyl)methanamine
CID 83635339
[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-4-propylcyclohexyl]methanamine
CID 63404646
(2-cyclohexylsulfanyl-4-phenylcyclohexyl)methanamine
CID 63404643
(2-pentan-2-yl-4-propylcyclohexyl)methanamine
CID 107889298
N-[[2-(cyclopentylmethyl)-4-propylcyclohexyl]methyl]-2-methylpropan-2-amine
CID 81025982
2-cyclopentylsulfanyl-4-methylcyclohexan-1-amine
CID 64626744

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine?
The IUPAC name of (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine (CID 63405084) is (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine.
What is the SMILES notation for (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine?
The canonical SMILES for (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine is CCCC1CCC(CN)C(SC2CCCC2)C1.
What is the InChIKey of (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine?
The InChIKey is ZGWOSBPLYODVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NS/c1-2-5-12-8-9-13(11-16)15(10-12)17-14-6-3-4-7-14/h12-15H,2-11,16H2,1H3.
What are the key properties of (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine?
(2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine has a molecular weight of 255.47 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylsulfanyl-4-propylcyclohexyl)methanamine is sourced from PubChem (CID 63405084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).