4,4-diethyl-1-(2-methylpropyl)piperidine;ethane

C19H45N — CID 154670691

IUPAC4,4-diethyl-1-(2-methylpropyl)piperidine;ethane
SMILESCC.CC.CC.CCC1(CC)CCN(CC(C)C)CC1
InChIInChI=1S/C13H27N.3C2H6/c1-5-13(6-2)7-9-14(10-8-13)11-12(3)4;3*1-2/h12H,5-11H2,1-4H3;3*1-2H3
InChIKeyRZYIHZOVDHNIMU-UHFFFAOYSA-N
MW287.58 g/mol
LogP6.62
Rot. Bonds4

About 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane

4,4-diethyl-1-(2-methylpropyl)piperidine;ethane (PubChem CID 154670691) has the molecular formula C19H45N and a molecular weight of 287.58 g/mol. Its IUPAC name is 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane.

Molecular Properties

Compound Name4,4-diethyl-1-(2-methylpropyl)piperidine;ethane
PubChem CID154670691
Molecular FormulaC19H45N
Molecular Weight287.58 g/mol
Exact Mass287.36
IUPAC Name4,4-diethyl-1-(2-methylpropyl)piperidine;ethane
SMILESCC.CC.CC.CCC1(CC)CCN(CC(C)C)CC1
InChIInChI=1S/C13H27N.3C2H6/c1-5-13(6-2)7-9-14(10-8-13)11-12(3)4;3*1-2/h12H,5-11H2,1-4H3;3*1-2H3
InChIKeyRZYIHZOVDHNIMU-UHFFFAOYSA-N
XLogP6.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.58
LogP ≤ 56.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-2-(4,4-diethylpiperidin-1-yl)ethanamine
CID 63913044
CID 174109893
CID 174109893
2,8-bis(2-methylpropyl)-2,8-diazaspiro[4.5]decane
CID 129193421
3-(2-methylbutyl)-9-(2-methylpropyl)-3,9-diazaspiro[5.5]undecane
CID 156860444
4-methyl-1,4-bis(2-methylpropyl)piperidine
CID 176612276
4-(4,4-diethylpiperidin-1-yl)butan-2-amine
CID 63160822
ethane;1-[9-(2-methylpropyl)-3,9-diazaspiro[5.5]undecan-3-yl]propan-1-one
CID 155707184
9-butyl-3-(2-methylpropyl)-3,9-diazaspiro[5.5]undecane
CID 163400374
1-(4,4-diethylpiperidin-1-yl)-3-methoxy-3-methylbutan-2-ol
CID 114228753
1-(4,4-diethylpiperidin-1-yl)-4-methoxybutan-2-amine
CID 55159302
1-(4,4-diethylpiperidin-1-yl)-N-propylpentan-2-amine
CID 63468589
[4-(2-methylpropyl)piperazin-1-yl]methanol
CID 58575664

Frequently Asked Questions

What is the IUPAC name of 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane?
The IUPAC name of 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane (CID 154670691) is 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane.
What is the SMILES notation for 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane?
The canonical SMILES for 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane is CC.CC.CC.CCC1(CC)CCN(CC(C)C)CC1.
What is the InChIKey of 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane?
The InChIKey is RZYIHZOVDHNIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N.3C2H6/c1-5-13(6-2)7-9-14(10-8-13)11-12(3)4;3*1-2/h12H,5-11H2,1-4H3;3*1-2H3.
What are the key properties of 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane?
4,4-diethyl-1-(2-methylpropyl)piperidine;ethane has a molecular weight of 287.58 g/mol, XLogP of 6.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethyl-1-(2-methylpropyl)piperidine;ethane is sourced from PubChem (CID 154670691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).