[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine

C17H34N2 — CID 103494626

IUPAC[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCC1CC(C)CC(CN)(N2CCC(C(C)C)CC2)C1
InChIInChI=1S/C17H34N2/c1-13(2)16-5-7-19(8-6-16)17(12-18)10-14(3)9-15(4)11-17/h13-16H,5-12,18H2,1-4H3
InChIKeyBZILGKRFTAIORK-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.51
Rot. Bonds3

About [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine

[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine (PubChem CID 103494626) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine
PubChem CID103494626
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCC1CC(C)CC(CN)(N2CCC(C(C)C)CC2)C1
InChIInChI=1S/C17H34N2/c1-13(2)16-5-7-19(8-6-16)17(12-18)10-14(3)9-15(4)11-17/h13-16H,5-12,18H2,1-4H3
InChIKeyBZILGKRFTAIORK-UHFFFAOYSA-N
XLogP3.51
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(4-ethoxypiperidin-1-yl)-3,5-dimethylcyclohexyl]methanamine
CID 64751461
[3-methoxy-1-(4-propan-2-ylpiperidin-1-yl)cyclobutyl]methanamine
CID 106822368
[1-(4-methylazepan-1-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 55248044
[3,5-dimethyl-1-(1,4-thiazepan-4-yl)cyclohexyl]methanamine
CID 64752644
[1-(4-propan-2-ylpiperidin-1-yl)-4-(trifluoromethyl)cyclohexyl]methanamine
CID 103494802
[1-methyl-4-(4-propan-2-ylpiperidin-1-yl)azepan-4-yl]methanamine
CID 103494627
[1-(4,4-diethylpiperidin-1-yl)-3-methylcyclobutyl]methanamine
CID 103562886
(3-methyl-1-pyrrolidin-1-ylcyclohexyl)methanamine
CID 24695310
[1-(4,4-dimethylpiperidin-1-yl)-3-methylcyclopentyl]methanamine
CID 64500940
[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine
CID 64501768
[1-(4-butan-2-ylpiperazin-1-yl)-3-methylcyclopentyl]methanamine
CID 64500744
[1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-3-propan-2-ylcyclobutyl]methanamine
CID 103563040

Frequently Asked Questions

What is the IUPAC name of [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine (CID 103494626) is [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine is CC1CC(C)CC(CN)(N2CCC(C(C)C)CC2)C1.
What is the InChIKey of [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine?
The InChIKey is BZILGKRFTAIORK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13(2)16-5-7-19(8-6-16)17(12-18)10-14(3)9-15(4)11-17/h13-16H,5-12,18H2,1-4H3.
What are the key properties of [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine?
[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine has a molecular weight of 266.47 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 103494626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).