N-ethyl-1-propylcyclohexan-1-amine

C11H23N — CID 581031

IUPACN-ethyl-1-propylcyclohexan-1-amine
SMILESCCCC1(NCC)CCCCC1
InChIInChI=1S/C11H23N/c1-3-8-11(12-4-2)9-6-5-7-10-11/h12H,3-10H2,1-2H3
InChIKeyYYYRTAOQDSZFFZ-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.10
Rot. Bonds4

About N-ethyl-1-propylcyclohexan-1-amine

N-ethyl-1-propylcyclohexan-1-amine (PubChem CID 581031) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-ethyl-1-propylcyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-propylcyclohexan-1-amine
PubChem CID581031
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-ethyl-1-propylcyclohexan-1-amine
SMILESCCCC1(NCC)CCCCC1
InChIInChI=1S/C11H23N/c1-3-8-11(12-4-2)9-6-5-7-10-11/h12H,3-10H2,1-2H3
InChIKeyYYYRTAOQDSZFFZ-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-propylcyclohexan-1-amine?
The IUPAC name of N-ethyl-1-propylcyclohexan-1-amine (CID 581031) is N-ethyl-1-propylcyclohexan-1-amine.
What is the SMILES notation for N-ethyl-1-propylcyclohexan-1-amine?
The canonical SMILES for N-ethyl-1-propylcyclohexan-1-amine is CCCC1(NCC)CCCCC1.
What is the InChIKey of N-ethyl-1-propylcyclohexan-1-amine?
The InChIKey is YYYRTAOQDSZFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-3-8-11(12-4-2)9-6-5-7-10-11/h12H,3-10H2,1-2H3.
What are the key properties of N-ethyl-1-propylcyclohexan-1-amine?
N-ethyl-1-propylcyclohexan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-propylcyclohexan-1-amine is sourced from PubChem (CID 581031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).