2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine

C15H29N — CID 65423192

IUPAC2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine
SMILESCCCC1CCC(C(CC2CC2)NC)CC1
InChIInChI=1S/C15H29N/c1-3-4-12-7-9-14(10-8-12)15(16-2)11-13-5-6-13/h12-16H,3-11H2,1-2H3
InChIKeyDDFLCNWXYUSCIU-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.98
Rot. Bonds6

About 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine

2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine (PubChem CID 65423192) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine
PubChem CID65423192
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine
SMILESCCCC1CCC(C(CC2CC2)NC)CC1
InChIInChI=1S/C15H29N/c1-3-4-12-7-9-14(10-8-12)15(16-2)11-13-5-6-13/h12-16H,3-11H2,1-2H3
InChIKeyDDFLCNWXYUSCIU-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The IUPAC name of 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine (CID 65423192) is 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The canonical SMILES for 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine is CCCC1CCC(C(CC2CC2)NC)CC1.
What is the InChIKey of 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The InChIKey is DDFLCNWXYUSCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-3-4-12-7-9-14(10-8-12)15(16-2)11-13-5-6-13/h12-16H,3-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine?
2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine has a molecular weight of 223.40 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine is sourced from PubChem (CID 65423192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).