3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol

C12H26N2O — CID 129310394

IUPAC3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol
SMILESCCCC(C)(CC)N1CCC(O)C(N)C1
InChIInChI=1S/C12H26N2O/c1-4-7-12(3,5-2)14-8-6-11(15)10(13)9-14/h10-11,15H,4-9,13H2,1-3H3
InChIKeyWJXJNDINHYFCFM-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.35
Rot. Bonds4

About 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol

3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol (PubChem CID 129310394) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol.

Molecular Properties

Compound Name3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol
PubChem CID129310394
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol
SMILESCCCC(C)(CC)N1CCC(O)C(N)C1
InChIInChI=1S/C12H26N2O/c1-4-7-12(3,5-2)14-8-6-11(15)10(13)9-14/h10-11,15H,4-9,13H2,1-3H3
InChIKeyWJXJNDINHYFCFM-UHFFFAOYSA-N
XLogP1.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol
CID 90286839
[4-methyl-1-(3-methylhexan-3-yl)pyrrolidin-3-yl]methanamine
CID 155370662
(3S,4S)-1-tert-butyl-3-propylpiperidin-4-ol
CID 171581887
(3S,4R)-1-tert-butyl-3-propylpiperidin-4-ol
CID 171581981
(3R,4S)-1-tert-butyl-3-propylpiperidin-4-ol
CID 171581949
(3R)-N-methyl-1-(3-methylheptan-3-yl)pyrrolidin-3-amine
CID 139373164
4-methyl-1-(7-methyltridecan-7-yl)piperidin-3-amine
CID 130337153
(3R,4R)-4-amino-1-tert-butylpyrrolidin-3-ol
CID 158152274
N,N-diethyl-1-(3-methyloctan-3-yl)pyrrolidin-3-amine
CID 137379854
N-[[1-(3-methylpentan-3-yl)pyrrolidin-3-yl]methyl]propan-1-amine
CID 106329245
(1R,5S)-3-(3-methylhexan-3-yl)-3-azabicyclo[3.1.0]hexan-1-amine
CID 139362761
2-methyl-2-(4-methylpiperidin-1-yl)butan-1-amine
CID 24689599

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol?
The IUPAC name of 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol (CID 129310394) is 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol.
What is the SMILES notation for 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol?
The canonical SMILES for 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol is CCCC(C)(CC)N1CCC(O)C(N)C1.
What is the InChIKey of 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol?
The InChIKey is WJXJNDINHYFCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-7-12(3,5-2)14-8-6-11(15)10(13)9-14/h10-11,15H,4-9,13H2,1-3H3.
What are the key properties of 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol?
3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol has a molecular weight of 214.35 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(3-methylhexan-3-yl)piperidin-4-ol is sourced from PubChem (CID 129310394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).