4-ethyl-1-(3-methylhexyl)piperidine

C14H29N — CID 176984647

IUPAC4-ethyl-1-(3-methylhexyl)piperidine
SMILESCCCC(C)CCN1CCC(CC)CC1
InChIInChI=1S/C14H29N/c1-4-6-13(3)7-10-15-11-8-14(5-2)9-12-15/h13-14H,4-12H2,1-3H3
InChIKeyBNIFHWHTRXUUNA-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.93
Rot. Bonds6

About 4-ethyl-1-(3-methylhexyl)piperidine

4-ethyl-1-(3-methylhexyl)piperidine (PubChem CID 176984647) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 4-ethyl-1-(3-methylhexyl)piperidine.

Molecular Properties

Compound Name4-ethyl-1-(3-methylhexyl)piperidine
PubChem CID176984647
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name4-ethyl-1-(3-methylhexyl)piperidine
SMILESCCCC(C)CCN1CCC(CC)CC1
InChIInChI=1S/C14H29N/c1-4-6-13(3)7-10-15-11-8-14(5-2)9-12-15/h13-14H,4-12H2,1-3H3
InChIKeyBNIFHWHTRXUUNA-UHFFFAOYSA-N
XLogP3.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-amino-4-(4-ethylpiperidin-1-yl)butan-2-ol
CID 64818908
1-(4-ethylpiperidin-1-yl)-4,4-dimethylpentan-3-ol
CID 62623574
4-(3-methylhexyl)thiomorpholine
CID 123685025
ethane;4-ethyl-1-(6-methylheptyl)piperidine
CID 170614915
3-(2-methylpentyl)-1-propylpyrrolidine
CID 123729662
4-(4-ethylpiperidin-1-yl)-2-(propan-2-ylamino)butanenitrile
CID 55144475
4-ethyl-1-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]piperidine
CID 158397131
ethane;2-(4-ethylpiperidin-1-yl)ethanol
CID 143029211
2-methyl-5-(4-propylpiperidin-1-yl)pentan-1-amine
CID 82016996
4-(4-ethylpiperidin-1-yl)-2-(methylamino)butanenitrile
CID 63029104
3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol
CID 115872854
6-(4-ethylpiperidin-1-yl)hexan-3-amine
CID 106799490

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(3-methylhexyl)piperidine?
The IUPAC name of 4-ethyl-1-(3-methylhexyl)piperidine (CID 176984647) is 4-ethyl-1-(3-methylhexyl)piperidine.
What is the SMILES notation for 4-ethyl-1-(3-methylhexyl)piperidine?
The canonical SMILES for 4-ethyl-1-(3-methylhexyl)piperidine is CCCC(C)CCN1CCC(CC)CC1.
What is the InChIKey of 4-ethyl-1-(3-methylhexyl)piperidine?
The InChIKey is BNIFHWHTRXUUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-4-6-13(3)7-10-15-11-8-14(5-2)9-12-15/h13-14H,4-12H2,1-3H3.
What are the key properties of 4-ethyl-1-(3-methylhexyl)piperidine?
4-ethyl-1-(3-methylhexyl)piperidine has a molecular weight of 211.39 g/mol, XLogP of 3.93, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(3-methylhexyl)piperidine is sourced from PubChem (CID 176984647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).