N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine

C18H33N — CID 64622957

IUPACN-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine
SMILESCCC(NC1CCCC(C2CC2)C1)C1CCCCC1
InChIInChI=1S/C18H33N/c1-2-18(15-7-4-3-5-8-15)19-17-10-6-9-16(13-17)14-11-12-14/h14-19H,2-13H2,1H3
InChIKeyZVDFRQNCEKMILG-UHFFFAOYSA-N
MW263.47 g/mol
LogP4.90
Rot. Bonds5

About N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine

N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine (PubChem CID 64622957) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine
PubChem CID64622957
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC NameN-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine
SMILESCCC(NC1CCCC(C2CC2)C1)C1CCCCC1
InChIInChI=1S/C18H33N/c1-2-18(15-7-4-3-5-8-15)19-17-10-6-9-16(13-17)14-11-12-14/h14-19H,2-13H2,1H3
InChIKeyZVDFRQNCEKMILG-UHFFFAOYSA-N
XLogP4.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.47
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine?
The IUPAC name of N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine (CID 64622957) is N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine.
What is the SMILES notation for N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine?
The canonical SMILES for N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine is CCC(NC1CCCC(C2CC2)C1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine?
The InChIKey is ZVDFRQNCEKMILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N/c1-2-18(15-7-4-3-5-8-15)19-17-10-6-9-16(13-17)14-11-12-14/h14-19H,2-13H2,1H3.
What are the key properties of N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine?
N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine has a molecular weight of 263.47 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpropyl)-3-cyclopropylcyclohexan-1-amine is sourced from PubChem (CID 64622957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).