N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine

C14H24N2S — CID 146416601

IUPACN,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine
SMILESCNCC1CCC(c2cccs2)(N(C)C)CC1
InChIInChI=1S/C14H24N2S/c1-15-11-12-6-8-14(9-7-12,16(2)3)13-5-4-10-17-13/h4-5,10,12,15H,6-9,11H2,1-3H3
InChIKeyFCXUPGLFWNIKSH-UHFFFAOYSA-N
MW252.43 g/mol
LogP2.91
Rot. Bonds4

About N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine

N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine (PubChem CID 146416601) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine
PubChem CID146416601
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC NameN,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine
SMILESCNCC1CCC(c2cccs2)(N(C)C)CC1
InChIInChI=1S/C14H24N2S/c1-15-11-12-6-8-14(9-7-12,16(2)3)13-5-4-10-17-13/h4-5,10,12,15H,6-9,11H2,1-3H3
InChIKeyFCXUPGLFWNIKSH-UHFFFAOYSA-N
XLogP2.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(dimethylamino)-4-thiophen-2-ylcyclohexan-1-ol
CID 138514846
benzyl N-[3-[[4-(dimethylamino)-4-thiophen-2-ylcyclohexyl]amino]-3-oxopropyl]carbamate
CID 11524775
1-[8-(dimethylamino)-8-thiophen-2-yl-2-azaspiro[4.5]decan-2-yl]-2-piperidin-4-ylethanone
CID 118666329
1-[8-(dimethylamino)-8-thiophen-2-yl-2-azaspiro[4.5]decan-2-yl]-2-(oxan-4-yl)ethanone
CID 118662425
N-[(3-bromophenyl)methyl]-N'-[4-(dimethylamino)-4-thiophen-2-ylcyclohexyl]pentanediamide
CID 140514148
butyl 4-(dimethylamino)-4-thiophen-2-ylpiperidine-1-carboxylate
CID 172683680
methyl N-[(1-thiophen-2-ylcyclopropyl)methyl]carbamate
CID 30522713
8-(dimethylamino)-2-methyl-8-thiophen-2-yl-2-azaspiro[4.5]decan-3-one
CID 118662018
2-(1-bicyclo[2.2.2]octanyl)thiophene
CID 140617889
8-(dimethylamino)-2-(2-methoxypropyl)-8-thiophen-2-yl-2-azaspiro[4.5]decan-3-one
CID 118662081
potassium;ethyl 2-[4-(dimethylamino)-4-thiophen-2-ylcyclohexylidene]acetate;2-methylpropan-2-olate
CID 159557704
N-[(2-methyl-2-thiophen-2-ylcyclopropyl)methyl]propan-1-amine
CID 62708007

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine?
The IUPAC name of N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine (CID 146416601) is N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine.
What is the SMILES notation for N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine?
The canonical SMILES for N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine is CNCC1CCC(c2cccs2)(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine?
The InChIKey is FCXUPGLFWNIKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-15-11-12-6-8-14(9-7-12,16(2)3)13-5-4-10-17-13/h4-5,10,12,15H,6-9,11H2,1-3H3.
What are the key properties of N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine?
N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(methylaminomethyl)-1-thiophen-2-ylcyclohexan-1-amine is sourced from PubChem (CID 146416601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).