N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine

C18H30N2S — CID 83998292

IUPACN-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine
SMILESCN1CC(Cc2cccs2)CC(NCC2CCCCC2)C1
InChIInChI=1S/C18H30N2S/c1-20-13-16(11-18-8-5-9-21-18)10-17(14-20)19-12-15-6-3-2-4-7-15/h5,8-9,15-17,19H,2-4,6-7,10-14H2,1H3
InChIKeyYBJRYOQPLNANOG-UHFFFAOYSA-N
MW306.52 g/mol
LogP3.78
Rot. Bonds5

About N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine

N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine (PubChem CID 83998292) has the molecular formula C18H30N2S and a molecular weight of 306.52 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine
PubChem CID83998292
Molecular FormulaC18H30N2S
Molecular Weight306.52 g/mol
Exact Mass306.21
IUPAC NameN-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine
SMILESCN1CC(Cc2cccs2)CC(NCC2CCCCC2)C1
InChIInChI=1S/C18H30N2S/c1-20-13-16(11-18-8-5-9-21-18)10-17(14-20)19-12-15-6-3-2-4-7-15/h5,8-9,15-17,19H,2-4,6-7,10-14H2,1H3
InChIKeyYBJRYOQPLNANOG-UHFFFAOYSA-N
XLogP3.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.52
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine 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-(cyclopropylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine
CID 83996218
N-(cyclohexylmethyl)-1-methyl-5-thiophen-2-ylpiperidin-3-amine
CID 83998289
N-(cyclohexylmethyl)-5-[(4-fluorophenyl)methyl]-1-methylpiperidin-3-amine
CID 83998287
1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine
CID 83988958
N-(cyclohexylmethyl)-5-(cyclopropylmethyl)-1-methylpiperidin-3-amine
CID 83998283
N-methyl-3-(thiophen-2-ylmethyl)cyclopentan-1-amine
CID 64505657
N-(cyclohexylmethyl)-1-cyclopropyl-5-thiophen-2-ylpiperidin-3-amine
CID 83998686
methyl N-[1-ethyl-5-(thiophen-2-ylmethyl)piperidin-3-yl]carbamate
CID 112543025
1-[5-(cyclopentylmethylamino)-1-methylpiperidin-3-yl]ethanol
CID 83997610
1-[5-(cyclopentylmethylamino)-1-methylpiperidin-3-yl]-3-methylbutan-2-ol
CID 83997613
N-(cyclopentylmethyl)-1-ethyl-5-(thiophen-3-ylmethyl)piperidin-3-amine
CID 83997648
5-benzyl-N-(cyclobutylmethyl)-1-ethylpiperidin-3-amine
CID 83996943

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine?
The IUPAC name of N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine (CID 83998292) is N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine?
The canonical SMILES for N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine is CN1CC(Cc2cccs2)CC(NCC2CCCCC2)C1.
What is the InChIKey of N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine?
The InChIKey is YBJRYOQPLNANOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2S/c1-20-13-16(11-18-8-5-9-21-18)10-17(14-20)19-12-15-6-3-2-4-7-15/h5,8-9,15-17,19H,2-4,6-7,10-14H2,1H3.
What are the key properties of N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine?
N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine has a molecular weight of 306.52 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-1-methyl-5-(thiophen-2-ylmethyl)piperidin-3-amine is sourced from PubChem (CID 83998292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).