N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine

C15H31N — CID 106830017

IUPACN,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine
SMILESCNC(CCC(C)(C)C)C1(C)CCCCC1
InChIInChI=1S/C15H31N/c1-14(2,3)12-9-13(16-5)15(4)10-7-6-8-11-15/h13,16H,6-12H2,1-5H3
InChIKeyCTBQWBIQFJPJJY-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds4

About N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine

N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine (PubChem CID 106830017) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine.

Molecular Properties

Compound NameN,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine
PubChem CID106830017
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine
SMILESCNC(CCC(C)(C)C)C1(C)CCCCC1
InChIInChI=1S/C15H31N/c1-14(2,3)12-9-13(16-5)15(4)10-7-6-8-11-15/h13,16H,6-12H2,1-5H3
InChIKeyCTBQWBIQFJPJJY-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methoxy-N,4-dimethyl-1-(1-methylcyclopentyl)pentan-1-amine
CID 103032388
1-(1-methoxycyclohexyl)-N,4,4-trimethylpentan-1-amine
CID 116762900
N-methyl-1-(1-methylcyclopentyl)pentan-1-amine
CID 115833048
[1-(1-ethylcyclopentyl)-4,4-dimethylpentyl]hydrazine
CID 105300036
2-(4-tert-butylphenyl)-N-methyl-1-(1-methylcyclohexyl)ethanamine
CID 106829968
N-methyl-1-(1-methylcyclohexyl)-3-(oxolan-2-yl)propan-1-amine
CID 106830218
1-(1-ethylcyclopentyl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103031615
[4-methoxy-4-methyl-1-(1-methylcyclopentyl)pentyl]hydrazine
CID 103026538
2-cyclopropyl-N-methyl-1-(1-methylcyclopentyl)ethanamine
CID 104986588
[4,4-dimethyl-1-(2-methylthiolan-2-yl)pentyl]hydrazine
CID 105300099
1-(5,5-dimethylhexan-2-yl)-1-methylcyclopropane
CID 123583157
N-methyl-1-(1-methylcyclohexyl)-2-propoxyethanamine
CID 106830336

Frequently Asked Questions

What is the IUPAC name of N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine?
The IUPAC name of N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine (CID 106830017) is N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine.
What is the SMILES notation for N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine?
The canonical SMILES for N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine is CNC(CCC(C)(C)C)C1(C)CCCCC1.
What is the InChIKey of N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine?
The InChIKey is CTBQWBIQFJPJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-14(2,3)12-9-13(16-5)15(4)10-7-6-8-11-15/h13,16H,6-12H2,1-5H3.
What are the key properties of N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine?
N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,4-trimethyl-1-(1-methylcyclohexyl)pentan-1-amine is sourced from PubChem (CID 106830017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).