N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine

C15H27N — CID 123153448

IUPACN,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine
SMILESCC=CC=C(C)CN(C)C1CCC(C)CC1
InChIInChI=1S/C15H27N/c1-5-6-7-14(3)12-16(4)15-10-8-13(2)9-11-15/h5-7,13,15H,8-12H2,1-4H3
InChIKeyOFADNEOLDGIUIJ-UHFFFAOYSA-N
MW221.39 g/mol
LogP4.02
Rot. Bonds4

About N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine

N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine (PubChem CID 123153448) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine
PubChem CID123153448
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC NameN,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine
SMILESCC=CC=C(C)CN(C)C1CCC(C)CC1
InChIInChI=1S/C15H27N/c1-5-6-7-14(3)12-16(4)15-10-8-13(2)9-11-15/h5-7,13,15H,8-12H2,1-4H3
InChIKeyOFADNEOLDGIUIJ-UHFFFAOYSA-N
XLogP4.02
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

2-[methyl-(4-methylcyclohexyl)amino]acetic acid
CID 60712035
N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine
CID 144654672
N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane
CID 144654671
3-methyl-1-[methyl-(4-methylcyclohexyl)amino]butan-2-one
CID 79396284
butyl 2-[methyl-(4-methylcyclohexyl)amino]acetate
CID 54940545
N-(2-aminoethyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 61438988
[cyclopropyl(methyl)amino]methanol
CID 89240777
N-cyclopropyl-2-[methyl-(4-methylcyclohexyl)amino]-N-(2-methylpropyl)acetamide
CID 78896010
N-[(E)-3-chloroprop-2-enyl]-N,4-dimethylcyclohexan-1-amine
CID 131245251
2-[[methyl-(4-methylcyclohexyl)amino]methyl]cycloheptan-1-ol
CID 62611154
N-[(E)-but-2-enyl]-N,3-dimethylcyclopentan-1-amine
CID 131245731
N-methyl-N-(4-methylcyclohexyl)but-2-enamide
CID 112725199

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine?
The IUPAC name of N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine (CID 123153448) is N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine.
What is the SMILES notation for N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine?
The canonical SMILES for N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine is CC=CC=C(C)CN(C)C1CCC(C)CC1.
What is the InChIKey of N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine?
The InChIKey is OFADNEOLDGIUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-5-6-7-14(3)12-16(4)15-10-8-13(2)9-11-15/h5-7,13,15H,8-12H2,1-4H3.
What are the key properties of N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine?
N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine has a molecular weight of 221.39 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine is sourced from PubChem (CID 123153448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).