(4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine

C14H23NS — CID 65423602

IUPAC(4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine
SMILESCC(C)C1CCC(C(N)c2cccs2)CC1
InChIInChI=1S/C14H23NS/c1-10(2)11-5-7-12(8-6-11)14(15)13-4-3-9-16-13/h3-4,9-12,14H,5-8,15H2,1-2H3
InChIKeyDCYIONDJAGOOSA-UHFFFAOYSA-N
MW237.41 g/mol
LogP4.21
Rot. Bonds3

About (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine

(4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine (PubChem CID 65423602) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name(4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine
PubChem CID65423602
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name(4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine
SMILESCC(C)C1CCC(C(N)c2cccs2)CC1
InChIInChI=1S/C14H23NS/c1-10(2)11-5-7-12(8-6-11)14(15)13-4-3-9-16-13/h3-4,9-12,14H,5-8,15H2,1-2H3
InChIKeyDCYIONDJAGOOSA-UHFFFAOYSA-N
XLogP4.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl(thiophen-2-yl)methanamine
CID 5015827
(2-methylthiophen-3-yl)-(4-propan-2-ylcyclohexyl)methanamine
CID 102832815
cumene;2,3-dimethylbutane;propan-2-ylcyclopropane;2-propan-2-ylthiophene
CID 159329708
(1R,2R)-1,2-dithiophen-2-ylethane-1,2-diamine
CID 156789144
N-[cyclopropyl(thiophen-2-yl)methyl]propan-2-amine
CID 60713978
3-propan-2-yl-N-(1-thiophen-2-ylethyl)cyclohexan-1-amine
CID 107447910
2-amino-N-[cyclopropyl(thiophen-2-yl)methyl]propanamide;hydrochloride
CID 119276253
2-propan-2-ylthiophene
CID 178128598
2-cyclopentyl-2-thiophen-2-ylethanamine
CID 55269689
2-cyclopentyl-1-thiophen-2-ylethanamine
CID 43823389
2-cyclopropyl-2-thiophen-2-ylethanol
CID 64989110
(4-methylphenyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 65424560

Frequently Asked Questions

What is the IUPAC name of (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine?
The IUPAC name of (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine (CID 65423602) is (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine.
What is the SMILES notation for (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine?
The canonical SMILES for (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine is CC(C)C1CCC(C(N)c2cccs2)CC1.
What is the InChIKey of (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine?
The InChIKey is DCYIONDJAGOOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-10(2)11-5-7-12(8-6-11)14(15)13-4-3-9-16-13/h3-4,9-12,14H,5-8,15H2,1-2H3.
What are the key properties of (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine?
(4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine has a molecular weight of 237.41 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propan-2-ylcyclohexyl)-thiophen-2-ylmethanamine is sourced from PubChem (CID 65423602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).