N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine

C17H29N — CID 118178816

IUPACN-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine
SMILESCC1(C)C=C1N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C17H29N/c1-17(2)13-16(17)18(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h13-15H,3-12H2,1-2H3
InChIKeyOBCGEDNJJSUTPI-UHFFFAOYSA-N
MW247.43 g/mol
LogP4.88
Rot. Bonds3

About N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine

N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine (PubChem CID 118178816) has the molecular formula C17H29N and a molecular weight of 247.43 g/mol. Its IUPAC name is N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine.

Molecular Properties

Compound NameN-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine
PubChem CID118178816
Molecular FormulaC17H29N
Molecular Weight247.43 g/mol
Exact Mass247.23
IUPAC NameN-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine
SMILESCC1(C)C=C1N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C17H29N/c1-17(2)13-16(17)18(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h13-15H,3-12H2,1-2H3
InChIKeyOBCGEDNJJSUTPI-UHFFFAOYSA-N
XLogP4.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.43
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine?
The IUPAC name of N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine (CID 118178816) is N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine.
What is the SMILES notation for N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine?
The canonical SMILES for N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine is CC1(C)C=C1N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine?
The InChIKey is OBCGEDNJJSUTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N/c1-17(2)13-16(17)18(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h13-15H,3-12H2,1-2H3.
What are the key properties of N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine?
N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine has a molecular weight of 247.43 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(3,3-dimethylcyclopropen-1-yl)cyclohexanamine is sourced from PubChem (CID 118178816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).