N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine

C15H27N — CID 126700057

IUPACN-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine
SMILESC=C(CC(C)(C)C)NC(=C)C1CCCCC1
InChIInChI=1S/C15H27N/c1-12(11-15(3,4)5)16-13(2)14-9-7-6-8-10-14/h14,16H,1-2,6-11H2,3-5H3
InChIKeyTWIZEYCAKSUOKJ-UHFFFAOYSA-N
MW221.39 g/mol
LogP4.62
Rot. Bonds4

About N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine

N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine (PubChem CID 126700057) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine
PubChem CID126700057
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC NameN-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine
SMILESC=C(CC(C)(C)C)NC(=C)C1CCCCC1
InChIInChI=1S/C15H27N/c1-12(11-15(3,4)5)16-13(2)14-9-7-6-8-10-14/h14,16H,1-2,6-11H2,3-5H3
InChIKeyTWIZEYCAKSUOKJ-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine?
The IUPAC name of N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine (CID 126700057) is N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine.
What is the SMILES notation for N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine?
The canonical SMILES for N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine is C=C(CC(C)(C)C)NC(=C)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine?
The InChIKey is TWIZEYCAKSUOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-12(11-15(3,4)5)16-13(2)14-9-7-6-8-10-14/h14,16H,1-2,6-11H2,3-5H3.
What are the key properties of N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine?
N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine has a molecular weight of 221.39 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethenyl)-4,4-dimethylpent-1-en-2-amine is sourced from PubChem (CID 126700057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).