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

C11H23N — CID 21043840

IUPACN-(1-cyclohexylethyl)propan-2-amine
SMILESCC(C)NC(C)C1CCCCC1
InChIInChI=1S/C11H23N/c1-9(2)12-10(3)11-7-5-4-6-8-11/h9-12H,4-8H2,1-3H3
InChIKeyNPPZYRYJLGDVAJ-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.95
Rot. Bonds3

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

N-(1-cyclohexylethyl)propan-2-amine (PubChem CID 21043840) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)propan-2-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)propan-2-amine
PubChem CID21043840
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-(1-cyclohexylethyl)propan-2-amine
SMILESCC(C)NC(C)C1CCCCC1
InChIInChI=1S/C11H23N/c1-9(2)12-10(3)11-7-5-4-6-8-11/h9-12H,4-8H2,1-3H3
InChIKeyNPPZYRYJLGDVAJ-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)propan-2-amine?
The IUPAC name of N-(1-cyclohexylethyl)propan-2-amine (CID 21043840) is N-(1-cyclohexylethyl)propan-2-amine.
What is the SMILES notation for N-(1-cyclohexylethyl)propan-2-amine?
The canonical SMILES for N-(1-cyclohexylethyl)propan-2-amine is CC(C)NC(C)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylethyl)propan-2-amine?
The InChIKey is NPPZYRYJLGDVAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9(2)12-10(3)11-7-5-4-6-8-11/h9-12H,4-8H2,1-3H3.
What are the key properties of N-(1-cyclohexylethyl)propan-2-amine?
N-(1-cyclohexylethyl)propan-2-amine has a molecular weight of 169.31 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)propan-2-amine is sourced from PubChem (CID 21043840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).