4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine

C16H32N2 — CID 62416677

IUPAC4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine
SMILESCCC1CCC(NCCC2CCCCN2C)CC1
InChIInChI=1S/C16H32N2/c1-3-14-7-9-15(10-8-14)17-12-11-16-6-4-5-13-18(16)2/h14-17H,3-13H2,1-2H3
InChIKeyXPBGNXNBPMTTAF-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds5

About 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine

4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine (PubChem CID 62416677) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine
PubChem CID62416677
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine
SMILESCCC1CCC(NCCC2CCCCN2C)CC1
InChIInChI=1S/C16H32N2/c1-3-14-7-9-15(10-8-14)17-12-11-16-6-4-5-13-18(16)2/h14-17H,3-13H2,1-2H3
InChIKeyXPBGNXNBPMTTAF-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine
CID 107913673
1-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]piperidin-4-amine
CID 60694644
4-ethyl-N-[(1-methylpyrrolidin-2-yl)methyl]cyclohexan-1-amine
CID 103626242
N-(2-cyclopentylethyl)-4-ethylcyclohexan-1-amine
CID 63450135
N-ethyl-2-(1-methylpiperidin-2-yl)ethanamine
CID 60685781
4-ethyl-N-(3-pyrrolidin-1-ylpropyl)cyclohexan-1-amine
CID 28657772
4-ethyl-N-[2-(1-methylpiperidin-4-yl)ethyl]cycloheptan-1-amine
CID 114515181
4-N-methyl-4-N-[2-(1-methylpiperidin-2-yl)ethyl]-1-N-propylcyclohexane-1,4-diamine
CID 107910875
(2R)-2-ethyl-1-methylpiperidine
CID 67552955
4-ethyl-N-[3-(2-methylpiperidin-1-yl)propyl]cyclohexan-1-amine
CID 43079554
ethane;N-[2-(1-methylpiperidin-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 161410894
2-ethyl-2-[2-(1-methylpiperidin-2-yl)ethylamino]butan-1-ol
CID 62518488

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine (CID 62416677) is 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine is CCC1CCC(NCCC2CCCCN2C)CC1.
What is the InChIKey of 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine?
The InChIKey is XPBGNXNBPMTTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-3-14-7-9-15(10-8-14)17-12-11-16-6-4-5-13-18(16)2/h14-17H,3-13H2,1-2H3.
What are the key properties of 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine?
4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 62416677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).