N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine

C17H34N2 — CID 115708700

IUPACN-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine
SMILESCC1CN(C)CCC1NC1CCCCC1C(C)(C)C
InChIInChI=1S/C17H34N2/c1-13-12-19(5)11-10-15(13)18-16-9-7-6-8-14(16)17(2,3)4/h13-16,18H,6-12H2,1-5H3
InChIKeyOTCWNVSHJUJVPL-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds2

About N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine

N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine (PubChem CID 115708700) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine
PubChem CID115708700
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine
SMILESCC1CN(C)CCC1NC1CCCCC1C(C)(C)C
InChIInChI=1S/C17H34N2/c1-13-12-19(5)11-10-15(13)18-16-9-7-6-8-14(16)17(2,3)4/h13-16,18H,6-12H2,1-5H3
InChIKeyOTCWNVSHJUJVPL-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-[(1,3-dimethylpiperidin-4-yl)amino]cyclopentan-1-ol
CID 115891311
1,3-dimethyl-N-(2-methylcyclobutyl)piperidin-4-amine
CID 130171575
2-[(1,3-dimethylpiperidin-4-yl)amino]cyclohexane-1-carbonitrile
CID 114503438
N-(1,3-dimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 115709714
N-(1,3-dimethylpiperidin-4-yl)-1,2,5-trimethylpiperidin-4-amine
CID 113261212
1,3-dimethyl-N-(2-piperidin-2-ylcyclopentyl)piperidin-4-amine
CID 114503181
(3S)-1-methyl-N-[(1S,2R)-2-methylcyclohexyl]pyrrolidin-3-amine
CID 124708701
N-(2-tert-butylcyclohexyl)-1,2-dimethylpiperidin-4-amine
CID 81298342
1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidin-4-amine
CID 115714383
1,3-dimethyl-N-(thian-4-yl)piperidin-4-amine
CID 115615447
1-methyl-N-(2-methylcyclopentyl)pyrrolidin-3-amine
CID 63278241
1,3-dimethyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)piperidin-4-amine
CID 115728295

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
The IUPAC name of N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine (CID 115708700) is N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine.
What is the SMILES notation for N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
The canonical SMILES for N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine is CC1CN(C)CCC1NC1CCCCC1C(C)(C)C.
What is the InChIKey of N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
The InChIKey is OTCWNVSHJUJVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13-12-19(5)11-10-15(13)18-16-9-7-6-8-14(16)17(2,3)4/h13-16,18H,6-12H2,1-5H3.
What are the key properties of N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine?
N-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-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-(2-tert-butylcyclohexyl)-1,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 115708700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).