6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine

C19H38N2 — CID 79842434

IUPAC6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
SMILESCCCNC1C(CN2CCCCC2CC)CCCC1(C)C
InChIInChI=1S/C19H38N2/c1-5-13-20-18-16(10-9-12-19(18,3)4)15-21-14-8-7-11-17(21)6-2/h16-18,20H,5-15H2,1-4H3
InChIKeySDSFBUUKTKMYIB-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.45
Rot. Bonds6

About 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine

6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine (PubChem CID 79842434) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
PubChem CID79842434
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
SMILESCCCNC1C(CN2CCCCC2CC)CCCC1(C)C
InChIInChI=1S/C19H38N2/c1-5-13-20-18-16(10-9-12-19(18,3)4)15-21-14-8-7-11-17(21)6-2/h16-18,20H,5-15H2,1-4H3
InChIKeySDSFBUUKTKMYIB-UHFFFAOYSA-N
XLogP4.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 79866086
6-[(2,3-dimethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842625
6-[(4-ethylpiperazin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842409
1-[[3,3-dimethyl-2-(propylamino)cyclohexyl]methyl]piperidin-4-ol
CID 79852206
2-[(2-ethylpyrrolidin-1-yl)methyl]-N-propylcyclopentan-1-amine
CID 62615155
6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylmethyl)-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 115561967
1-[[3,3-dimethyl-2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-ol
CID 79848410
2,2-dimethyl-N-propyl-6-(2-propylpiperidin-1-yl)cyclohexan-1-amine
CID 83053137
5-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethylcyclopentan-1-amine
CID 79865483
5-[(2-ethylazepan-1-yl)methyl]-2,2-dimethylcyclopentan-1-ol
CID 104692099
N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 79865475
N-ethyl-2-[(2-ethylazepan-1-yl)methyl]cyclohexan-1-amine
CID 104692037

Frequently Asked Questions

What is the IUPAC name of 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine?
The IUPAC name of 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine (CID 79842434) is 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine.
What is the SMILES notation for 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine?
The canonical SMILES for 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine is CCCNC1C(CN2CCCCC2CC)CCCC1(C)C.
What is the InChIKey of 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine?
The InChIKey is SDSFBUUKTKMYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-5-13-20-18-16(10-9-12-19(18,3)4)15-21-14-8-7-11-17(21)6-2/h16-18,20H,5-15H2,1-4H3.
What are the key properties of 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine?
6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine has a molecular weight of 294.53 g/mol, XLogP of 4.45, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine is sourced from PubChem (CID 79842434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).