1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine

C14H23NS — CID 105157838

IUPAC1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine
SMILESCNC(CCCc1cccs1)CCC1CC1
InChIInChI=1S/C14H23NS/c1-15-13(10-9-12-7-8-12)4-2-5-14-6-3-11-16-14/h3,6,11-13,15H,2,4-5,7-10H2,1H3
InChIKeyMPENQTDIYIWHNO-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.85
Rot. Bonds8

About 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine

1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine (PubChem CID 105157838) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine
PubChem CID105157838
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine
SMILESCNC(CCCc1cccs1)CCC1CC1
InChIInChI=1S/C14H23NS/c1-15-13(10-9-12-7-8-12)4-2-5-14-6-3-11-16-14/h3,6,11-13,15H,2,4-5,7-10H2,1H3
InChIKeyMPENQTDIYIWHNO-UHFFFAOYSA-N
XLogP3.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-phenyl-6-thiophen-2-ylhexan-3-amine
CID 105094221
N-methyl-1-methylsulfonyl-7-thiophen-2-ylheptan-4-amine
CID 105113307
N-methyl-6-phenyl-1-thiophen-2-ylhexan-3-amine
CID 105150151
1-cyclopentyl-6-thiophen-2-ylhexan-3-ol
CID 114193701
1-cyclobutyl-N-methyl-4-thiophen-2-ylbutan-2-amine
CID 103168696
N-methyl-1-thiophen-2-yldodecan-3-amine
CID 115860959
1-cyclopentyl-N-ethyl-5-thiophen-2-ylpentan-2-amine
CID 105139096
N-methyl-1-(2-methylphenyl)-5-thiophen-2-ylpentan-2-amine
CID 61065069
1-cyclohexyl-N-methyl-6-phenylhexan-3-amine
CID 115849338
N-ethyl-1-(oxan-4-yl)-5-thiophen-2-ylpentan-2-amine
CID 105138838
1-(2-chloro-3-fluorophenyl)-N-methyl-5-thiophen-2-ylpentan-2-amine
CID 105178932
N-methyl-1-(oxolan-3-yl)-4-thiophen-2-ylbutan-2-amine
CID 103986936

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine?
The IUPAC name of 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine (CID 105157838) is 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine?
The canonical SMILES for 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine is CNC(CCCc1cccs1)CCC1CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine?
The InChIKey is MPENQTDIYIWHNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-15-13(10-9-12-7-8-12)4-2-5-14-6-3-11-16-14/h3,6,11-13,15H,2,4-5,7-10H2,1H3.
What are the key properties of 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine?
1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine has a molecular weight of 237.41 g/mol, XLogP of 3.85, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine is sourced from PubChem (CID 105157838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).