N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine

C16H31N — CID 64764257

IUPACN,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine
SMILESC=CCCCC(C)(C)C1CCC(C)CC1NC
InChIInChI=1S/C16H31N/c1-6-7-8-11-16(3,4)14-10-9-13(2)12-15(14)17-5/h6,13-15,17H,1,7-12H2,2-5H3
InChIKeyLQVLALADFKVJOA-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.39
Rot. Bonds6

About N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine

N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine (PubChem CID 64764257) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound NameN,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine
PubChem CID64764257
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC NameN,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine
SMILESC=CCCCC(C)(C)C1CCC(C)CC1NC
InChIInChI=1S/C16H31N/c1-6-7-8-11-16(3,4)14-10-9-13(2)12-15(14)17-5/h6,13-15,17H,1,7-12H2,2-5H3
InChIKeyLQVLALADFKVJOA-UHFFFAOYSA-N
XLogP4.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,5-dimethyl-2-(2-methyldecan-2-yl)cyclohexan-1-amine
CID 64764075
2-chloro-4-methyl-1-(2-methylnon-8-en-2-yl)cyclohexane
CID 107010551
2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine
CID 64765922
2-(5-methoxy-2-methylpentan-2-yl)-5-methyl-N-propylcyclohexan-1-amine
CID 64767574
N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine
CID 103131899
2-[1-(4-ethylphenyl)-2-methylpropan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64764067
N,5-dimethyl-2-[2-methyl-1-(1,3-thiazol-2-yl)propan-2-yl]cyclohexan-1-amine
CID 79825191
2-[1-(3,4-dichlorophenyl)-2-methylpropan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64765920
(1R,2S,5R)-5-methyl-2-(2-methylpent-4-en-2-yl)cyclohexan-1-ol
CID 130130703
2-(2,5-dimethylhexan-2-yl)-5-methyl-N-propylcyclohexan-1-amine
CID 64766423
5-methyl-2-(2-methylnonan-2-yl)cyclohexan-1-ol
CID 64766694
5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine
CID 64765358

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine?
The IUPAC name of N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine (CID 64764257) is N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine.
What is the SMILES notation for N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine?
The canonical SMILES for N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine is C=CCCCC(C)(C)C1CCC(C)CC1NC.
What is the InChIKey of N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine?
The InChIKey is LQVLALADFKVJOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-6-7-8-11-16(3,4)14-10-9-13(2)12-15(14)17-5/h6,13-15,17H,1,7-12H2,2-5H3.
What are the key properties of N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine?
N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 64764257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).