(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine

C12H23N — CID 142383031

IUPAC(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine
SMILESCC/C=C(\C1CCCCC1)N(C)C
InChIInChI=1S/C12H23N/c1-4-8-12(13(2)3)11-9-6-5-7-10-11/h8,11H,4-7,9-10H2,1-3H3/b12-8+
InChIKeyASVDPVQJUZMYTG-XYOKQWHBSA-N
MW181.32 g/mol
LogP3.42
Rot. Bonds3

About (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine

(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine (PubChem CID 142383031) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine.

Molecular Properties

Compound Name(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine
PubChem CID142383031
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine
SMILESCC/C=C(\C1CCCCC1)N(C)C
InChIInChI=1S/C12H23N/c1-4-8-12(13(2)3)11-9-6-5-7-10-11/h8,11H,4-7,9-10H2,1-3H3/b12-8+
InChIKeyASVDPVQJUZMYTG-XYOKQWHBSA-N
XLogP3.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 12319055
N,N,6-trimethylcyclohexen-1-amine
CID 12664021
N,N,4-trimethylcyclohexen-1-amine
CID 14318945
5-(1,1-difluoroethyl)-N,N-dimethylcyclohexen-1-amine
CID 68374648
1-[(Z)-1-cyclohexylprop-1-enyl]piperidine
CID 14248043
tetrahydromethyl-N,N-dimethylbenzylamine
CID 132427535
1-[(E)-1-cyclohexylprop-1-enyl]piperidine
CID 134932948
2-Cyclohexene-1-methanamine, N,N,2-trimethyl-5-(1-methylethenyl)-
CID 546873
Bicyclo[2.2.1]hept-2-en-2-amine, N,N-dimethyl-
CID 573072
Bicyclo[2.2.2]octa-2,5-diene, 2-dimethylamino-
CID 578316
1-(6-Butylcyclohex-1-en-1-yl)pyrrolidine
CID 53440329
1-(6-Ethylcyclohexen-1-yl)pyrrolidine
CID 102116981

Frequently Asked Questions

What is the IUPAC name of (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine?
The IUPAC name of (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine (CID 142383031) is (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine.
What is the SMILES notation for (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine?
The canonical SMILES for (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine is CC/C=C(\C1CCCCC1)N(C)C.
What is the InChIKey of (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine?
The InChIKey is ASVDPVQJUZMYTG-XYOKQWHBSA-N. The full InChI is InChI=1S/C12H23N/c1-4-8-12(13(2)3)11-9-6-5-7-10-11/h8,11H,4-7,9-10H2,1-3H3/b12-8+.
What are the key properties of (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine?
(E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine has a molecular weight of 181.32 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-cyclohexyl-N,N-dimethylbut-1-en-1-amine is sourced from PubChem (CID 142383031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).