N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine

C15H25NS — CID 55237095

IUPACN-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine
SMILESCCCNC1CCCCC1CCc1cccs1
InChIInChI=1S/C15H25NS/c1-2-11-16-15-8-4-3-6-13(15)9-10-14-7-5-12-17-14/h5,7,12-13,15-16H,2-4,6,8-11H2,1H3
InChIKeyFPPSRLRQDQNBSQ-UHFFFAOYSA-N
MW251.44 g/mol
LogP4.24
Rot. Bonds6

About N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine

N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine (PubChem CID 55237095) has the molecular formula C15H25NS and a molecular weight of 251.44 g/mol. Its IUPAC name is N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine
PubChem CID55237095
Molecular FormulaC15H25NS
Molecular Weight251.44 g/mol
Exact Mass251.17
IUPAC NameN-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine
SMILESCCCNC1CCCCC1CCc1cccs1
InChIInChI=1S/C15H25NS/c1-2-11-16-15-8-4-3-6-13(15)9-10-14-7-5-12-17-14/h5,7,12-13,15-16H,2-4,6,8-11H2,1H3
InChIKeyFPPSRLRQDQNBSQ-UHFFFAOYSA-N
XLogP4.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.44
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine?
The IUPAC name of N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine (CID 55237095) is N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine?
The canonical SMILES for N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine is CCCNC1CCCCC1CCc1cccs1.
What is the InChIKey of N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine?
The InChIKey is FPPSRLRQDQNBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS/c1-2-11-16-15-8-4-3-6-13(15)9-10-14-7-5-12-17-14/h5,7,12-13,15-16H,2-4,6,8-11H2,1H3.
What are the key properties of N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine?
N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine has a molecular weight of 251.44 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 55237095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).