N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine

C17H34N2 — CID 114592713

IUPACN,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine
SMILESCNC1CCC(C)(C)CC1N1CC(C)CC(C)C1C
InChIInChI=1S/C17H34N2/c1-12-9-13(2)14(3)19(11-12)16-10-17(4,5)8-7-15(16)18-6/h12-16,18H,7-11H2,1-6H3
InChIKeyVMBYHCZKXASFQM-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds2

About N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine

N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine (PubChem CID 114592713) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine.

Molecular Properties

Compound NameN,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine
PubChem CID114592713
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine
SMILESCNC1CCC(C)(C)CC1N1CC(C)CC(C)C1C
InChIInChI=1S/C17H34N2/c1-12-9-13(2)14(3)19(11-12)16-10-17(4,5)8-7-15(16)18-6/h12-16,18H,7-11H2,1-6H3
InChIKeyVMBYHCZKXASFQM-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N,4,4-trimethylcyclohexan-1-amine
CID 102726068
N,4,4-trimethyl-2-(2-propylpiperidin-1-yl)cyclohexan-1-amine
CID 83052319
7-(2,3-dimethylpiperidin-1-yl)-N-methyl-1,4-dioxaspiro[4.5]decan-8-amine
CID 62123551
2-(2,3,5-trimethylpiperidin-1-yl)cyclobutane-1-carboxylic acid
CID 114594006
2,3,5-trimethyl-1-(4-methylpiperidin-3-yl)piperidine
CID 114593555
2,3,5-trimethyl-1-(3-methylpiperidin-4-yl)piperidine
CID 114593551
[2-(2,3,5-trimethylpiperidin-1-yl)cyclohexyl]methanamine
CID 114592320
1-amino-3-(2,3,5-trimethylpiperidin-1-yl)cyclohexane-1-carboxylic acid
CID 114596385
1-(ethylamino)-3-(2,3,5-trimethylpiperidin-1-yl)cyclopentane-1-carboxylic acid
CID 114596405
2-[(3-methoxy-4-methylpiperidin-1-yl)methyl]-N,4,4-trimethylcyclohexan-1-amine
CID 102967140
2-(3,4-dimethylpyrrolidin-1-yl)-4,4-dimethylcyclohexan-1-amine
CID 79188144
1-(propylamino)-3-(2,3,5-trimethylpiperidin-1-yl)cyclopentane-1-carbonitrile
CID 114596275

Frequently Asked Questions

What is the IUPAC name of N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine?
The IUPAC name of N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine (CID 114592713) is N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine.
What is the SMILES notation for N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine?
The canonical SMILES for N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine is CNC1CCC(C)(C)CC1N1CC(C)CC(C)C1C.
What is the InChIKey of N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine?
The InChIKey is VMBYHCZKXASFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-12-9-13(2)14(3)19(11-12)16-10-17(4,5)8-7-15(16)18-6/h12-16,18H,7-11H2,1-6H3.
What are the key properties of N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine?
N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,4-trimethyl-2-(2,3,5-trimethylpiperidin-1-yl)cyclohexan-1-amine is sourced from PubChem (CID 114592713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).