[1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine

C17H34N2 — CID 65088627

IUPAC[1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine
SMILESCCC1CCCC(CN)(N2CCC(C)CC2C)CC1
InChIInChI=1S/C17H34N2/c1-4-16-6-5-9-17(13-18,10-7-16)19-11-8-14(2)12-15(19)3/h14-16H,4-13,18H2,1-3H3
InChIKeyFNCMWIIOADMPFI-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.79
Rot. Bonds3

About [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine

[1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine (PubChem CID 65088627) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine.

Molecular Properties

Compound Name[1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine
PubChem CID65088627
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name[1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine
SMILESCCC1CCCC(CN)(N2CCC(C)CC2C)CC1
InChIInChI=1S/C17H34N2/c1-4-16-6-5-9-17(13-18,10-7-16)19-11-8-14(2)12-15(19)3/h14-16H,4-13,18H2,1-3H3
InChIKeyFNCMWIIOADMPFI-UHFFFAOYSA-N
XLogP3.79
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 ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2,4-dimethylpiperidin-1-yl)-3-ethylcyclopentyl]methanamine
CID 64500735
[1-(2,4-dimethylpiperidin-1-yl)cyclopropyl]methanamine
CID 106661194
[4-(2,4-dimethylpiperidin-1-yl)-1-ethylazepan-4-yl]methanamine
CID 65076024
[4-(2,4-dimethylpiperidin-1-yl)thian-4-yl]methanamine
CID 62331186
[1-(2,4-dimethylpiperidin-1-yl)-4-(trifluoromethyl)cyclohexyl]methanamine
CID 64755313
[4-ethyl-1-(2-ethylpiperidin-1-yl)cycloheptyl]methanamine
CID 65088511
[3-(2,4-dimethylpiperidin-1-yl)thian-3-yl]methanamine
CID 62872574
[4-(2,4-dimethylpiperidin-1-yl)-1-propan-2-ylpiperidin-4-yl]methanamine
CID 55062043
[1-(2,4-dimethylpiperidin-1-yl)-3,3-dimethylcyclopentyl]methanamine
CID 80705152
[1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-4-ethylcyclohexyl]methanamine
CID 82746499
[4-ethyl-1-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)cyclohexyl]methanamine
CID 79941138
[4-ethyl-1-(4-methylsulfonylpiperazin-1-yl)cycloheptyl]methanamine
CID 65088134

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine?
The IUPAC name of [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine (CID 65088627) is [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine.
What is the SMILES notation for [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine?
The canonical SMILES for [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine is CCC1CCCC(CN)(N2CCC(C)CC2C)CC1.
What is the InChIKey of [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine?
The InChIKey is FNCMWIIOADMPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-16-6-5-9-17(13-18,10-7-16)19-11-8-14(2)12-15(19)3/h14-16H,4-13,18H2,1-3H3.
What are the key properties of [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine?
[1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine has a molecular weight of 266.47 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dimethylpiperidin-1-yl)-4-ethylcycloheptyl]methanamine is sourced from PubChem (CID 65088627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).