4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine

C16H32N2 — CID 63161620

IUPAC4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine
SMILESCCC1(C)CCN(CC2(CC)CCCNC2)CC1
InChIInChI=1S/C16H32N2/c1-4-15(3)8-11-18(12-9-15)14-16(5-2)7-6-10-17-13-16/h17H,4-14H2,1-3H3
InChIKeyWLUFAZOGFUMHEZ-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds4

About 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine

4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine (PubChem CID 63161620) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine.

Molecular Properties

Compound Name4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine
PubChem CID63161620
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine
SMILESCCC1(C)CCN(CC2(CC)CCCNC2)CC1
InChIInChI=1S/C16H32N2/c1-4-15(3)8-11-18(12-9-15)14-16(5-2)7-6-10-17-13-16/h17H,4-14H2,1-3H3
InChIKeyWLUFAZOGFUMHEZ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-4-methyl-1-[(3-propylpiperidin-3-yl)methyl]piperidine
CID 63161703
1-[(3-ethylpiperidin-3-yl)methyl]azocane
CID 55166633
4-ethyl-4-methyl-1-[(4-methylpiperidin-4-yl)methyl]piperidine
CID 55159111
7,7-dimethyl-4-[(3-propylpiperidin-3-yl)methyl]-1,4-thiazepane
CID 107456138
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-propylpiperazine
CID 55218735
2-ethyl-4-[(3-ethylpiperidin-3-yl)methyl]morpholine
CID 63132829
3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine
CID 55167023
1-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-1,4-diazepane
CID 63161230
ethane;2-(3-ethylpiperidin-3-yl)ethanamine
CID 143578860
1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine
CID 55165550
7,7-dimethyl-4-[(3-methylpiperidin-3-yl)methyl]-1,4-thiazepane
CID 107456174
3-(cyclopropylmethyl)-3-(pyrrolidin-1-ylmethyl)piperidine
CID 84687927

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine?
The IUPAC name of 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine (CID 63161620) is 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine.
What is the SMILES notation for 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine?
The canonical SMILES for 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine is CCC1(C)CCN(CC2(CC)CCCNC2)CC1.
What is the InChIKey of 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine?
The InChIKey is WLUFAZOGFUMHEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-15(3)8-11-18(12-9-15)14-16(5-2)7-6-10-17-13-16/h17H,4-14H2,1-3H3.
What are the key properties of 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine?
4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine is sourced from PubChem (CID 63161620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).