2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine

C16H34N2 — CID 146366488

IUPAC2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine
SMILESCN1CCCC(C(C)(C)CC(C)(N)C(C)(C)C)C1
InChIInChI=1S/C16H34N2/c1-14(2,3)16(6,17)12-15(4,5)13-9-8-10-18(7)11-13/h13H,8-12,17H2,1-7H3
InChIKeyHLXGRASTGVKSNW-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.51
Rot. Bonds3

About 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine

2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine (PubChem CID 146366488) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine.

Molecular Properties

Compound Name2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine
PubChem CID146366488
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine
SMILESCN1CCCC(C(C)(C)CC(C)(N)C(C)(C)C)C1
InChIInChI=1S/C16H34N2/c1-14(2,3)16(6,17)12-15(4,5)13-9-8-10-18(7)11-13/h13H,8-12,17H2,1-7H3
InChIKeyHLXGRASTGVKSNW-UHFFFAOYSA-N
XLogP3.51
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2,4-dimethyl-4-(oxiran-2-yl)pentan-2-yl]-1-methylpiperidine
CID 170290565
2-methyl-2-(1-methylpiperidin-3-yl)propane-1-thiol
CID 116866531
(3S)-3-tert-butyl-1-methylpiperidine
CID 129190972
4-N-[2-methyl-2-(1-methylpiperidin-3-yl)propyl]cyclohexane-1,4-diamine
CID 115149957
N-(chloromethyl)-2-methyl-2-(1-methylpiperidin-3-yl)propan-1-amine
CID 115263731
N-[2-methyl-2-(1-methylpiperidin-3-yl)propyl]acetamide
CID 115191508
[2-methyl-2-(1-methylpiperidin-3-yl)propyl]carbamothioic S-acid
CID 115170602
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-2-(1-methylpiperidin-3-yl)propan-1-amine
CID 115244469
2-hydroxy-2-methyl-N-[2-methyl-2-(1-methylpiperidin-3-yl)propyl]propanamide
CID 115179064
1-methyl-3-(2-methylbutan-2-yl)pyrrolidine
CID 129106499
3-fluoro-3-(1-methylpiperidin-3-yl)butan-2-amine
CID 105443310
3-methyl-2-[[2-methyl-2-(1-methylpiperidin-3-yl)propyl]amino]butan-1-ol
CID 115137861

Frequently Asked Questions

What is the IUPAC name of 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine?
The IUPAC name of 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine (CID 146366488) is 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine.
What is the SMILES notation for 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine?
The canonical SMILES for 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine is CN1CCCC(C(C)(C)CC(C)(N)C(C)(C)C)C1.
What is the InChIKey of 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine?
The InChIKey is HLXGRASTGVKSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-14(2,3)16(6,17)12-15(4,5)13-9-8-10-18(7)11-13/h13H,8-12,17H2,1-7H3.
What are the key properties of 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine?
2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine has a molecular weight of 254.46 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,5-tetramethyl-5-(1-methylpiperidin-3-yl)hexan-3-amine is sourced from PubChem (CID 146366488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).