N-(1-cyclohexylethenyl)propan-2-amine

C11H21N — CID 131998084

IUPACN-(1-cyclohexylethenyl)propan-2-amine
SMILESC=C(NC(C)C)C1CCCCC1
InChIInChI=1S/C11H21N/c1-9(2)12-10(3)11-7-5-4-6-8-11/h9,11-12H,3-8H2,1-2H3
InChIKeyKYHNMIFPDDHKIZ-UHFFFAOYSA-N
MW167.30 g/mol
LogP3.08
Rot. Bonds3

About N-(1-cyclohexylethenyl)propan-2-amine

N-(1-cyclohexylethenyl)propan-2-amine (PubChem CID 131998084) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-(1-cyclohexylethenyl)propan-2-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethenyl)propan-2-amine
PubChem CID131998084
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-(1-cyclohexylethenyl)propan-2-amine
SMILESC=C(NC(C)C)C1CCCCC1
InChIInChI=1S/C11H21N/c1-9(2)12-10(3)11-7-5-4-6-8-11/h9,11-12H,3-8H2,1-2H3
InChIKeyKYHNMIFPDDHKIZ-UHFFFAOYSA-N
XLogP3.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethenyl)propan-2-amine?
The IUPAC name of N-(1-cyclohexylethenyl)propan-2-amine (CID 131998084) is N-(1-cyclohexylethenyl)propan-2-amine.
What is the SMILES notation for N-(1-cyclohexylethenyl)propan-2-amine?
The canonical SMILES for N-(1-cyclohexylethenyl)propan-2-amine is C=C(NC(C)C)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylethenyl)propan-2-amine?
The InChIKey is KYHNMIFPDDHKIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9(2)12-10(3)11-7-5-4-6-8-11/h9,11-12H,3-8H2,1-2H3.
What are the key properties of N-(1-cyclohexylethenyl)propan-2-amine?
N-(1-cyclohexylethenyl)propan-2-amine has a molecular weight of 167.30 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethenyl)propan-2-amine is sourced from PubChem (CID 131998084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).