1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine

C14H24N2S — CID 64677713

IUPAC1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine
SMILESCN(CCC1(N)CCCCC1)Cc1cccs1
InChIInChI=1S/C14H24N2S/c1-16(12-13-6-5-11-17-13)10-9-14(15)7-3-2-4-8-14/h5-6,11H,2-4,7-10,12,15H2,1H3
InChIKeyNEZGTNCWVJUKCL-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.23
Rot. Bonds5

About 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine

1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine (PubChem CID 64677713) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine
PubChem CID64677713
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine
SMILESCN(CCC1(N)CCCCC1)Cc1cccs1
InChIInChI=1S/C14H24N2S/c1-16(12-13-6-5-11-17-13)10-9-14(15)7-3-2-4-8-14/h5-6,11H,2-4,7-10,12,15H2,1H3
InChIKeyNEZGTNCWVJUKCL-UHFFFAOYSA-N
XLogP3.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[methyl(2-thiophen-2-ylethyl)amino]ethyl]cyclohexan-1-amine
CID 79487873
1-[2-[ethyl(thiophen-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64679712
1-(2-thiophen-2-ylethyl)cyclopentan-1-amine
CID 63774974
1-[2-[cyclopropyl(thiophen-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64677499
1-[2-[benzyl(methyl)amino]ethyl]cyclopentan-1-amine
CID 64678874
1-[2-[methyl-[(3-methylphenyl)methyl]amino]ethyl]cyclohexan-1-amine
CID 64679512
1-[2-[(3-chlorophenyl)methyl-methylamino]ethyl]cyclohexan-1-amine
CID 64679518
1-[[methyl(thiophen-2-ylmethyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62277733
1-[2-[benzyl(methyl)amino]ethyl]cyclobutan-1-amine
CID 79842495
1-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]cyclobutan-1-amine
CID 81171454
4-(2-thiophen-2-ylethyl)oxepan-4-amine
CID 65076896
1-[2-[methyl(pyridin-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64677728

Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine?
The IUPAC name of 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine (CID 64677713) is 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine?
The canonical SMILES for 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine is CN(CCC1(N)CCCCC1)Cc1cccs1.
What is the InChIKey of 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine?
The InChIKey is NEZGTNCWVJUKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-16(12-13-6-5-11-17-13)10-9-14(15)7-3-2-4-8-14/h5-6,11H,2-4,7-10,12,15H2,1H3.
What are the key properties of 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine?
1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl(thiophen-2-ylmethyl)amino]ethyl]cyclohexan-1-amine is sourced from PubChem (CID 64677713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).