1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol

C14H30N2O — CID 106708252

IUPAC1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol
SMILESCC1CN(CCCCC(C)(C)CN)CCC1O
InChIInChI=1S/C14H30N2O/c1-12-10-16(9-6-13(12)17)8-5-4-7-14(2,3)11-15/h12-13,17H,4-11,15H2,1-3H3
InChIKeyQDJJCGMAPPBQBP-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.84
Rot. Bonds6

About 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol

1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol (PubChem CID 106708252) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol
PubChem CID106708252
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol
SMILESCC1CN(CCCCC(C)(C)CN)CCC1O
InChIInChI=1S/C14H30N2O/c1-12-10-16(9-6-13(12)17)8-5-4-7-14(2,3)11-15/h12-13,17H,4-11,15H2,1-3H3
InChIKeyQDJJCGMAPPBQBP-UHFFFAOYSA-N
XLogP1.84
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,2-dimethyl-6-(4-methylazepan-1-yl)hexan-1-amine
CID 106708126
2,2-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)hexan-1-amine
CID 106708095
(3S,4S)-1-(5-fluoropentyl)-3-methylpiperidin-4-ol
CID 124862124
1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide
CID 106707851
1-[3-(tert-butylamino)propyl]-3-methylpiperidin-4-ol
CID 114681079
6-(4-ethylpiperidin-1-yl)-2,2-dimethylhexan-1-amine
CID 106707970
2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine
CID 106707845
3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
CID 114502590
N-[1-(6-amino-5,5-dimethylhexyl)piperidin-4-yl]acetamide
CID 106708228
3-methyl-1-(2-piperidin-1-ylethyl)piperidin-4-ol
CID 114502746
5-[3-(methoxymethyl)pyrrolidin-1-yl]-2,2-dimethylpentan-1-amine
CID 65254280
2,2-dimethyl-5-(3-phenylpyrrolidin-1-yl)pentan-1-amine
CID 65254158

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol (CID 106708252) is 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol is CC1CN(CCCCC(C)(C)CN)CCC1O.
What is the InChIKey of 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol?
The InChIKey is QDJJCGMAPPBQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12-10-16(9-6-13(12)17)8-5-4-7-14(2,3)11-15/h12-13,17H,4-11,15H2,1-3H3.
What are the key properties of 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol?
1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol has a molecular weight of 242.41 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 106708252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).