2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol

C11H24N2O — CID 64787601

IUPAC2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol
SMILESCC1CCN(CCC(N)CO)C(C)C1
InChIInChI=1S/C11H24N2O/c1-9-3-5-13(10(2)7-9)6-4-11(12)8-14/h9-11,14H,3-8,12H2,1-2H3
InChIKeyJIGNTGLNHZMTQV-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.82
Rot. Bonds4

About 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol

2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol (PubChem CID 64787601) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol.

Molecular Properties

Compound Name2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol
PubChem CID64787601
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol
SMILESCC1CCN(CCC(N)CO)C(C)C1
InChIInChI=1S/C11H24N2O/c1-9-3-5-13(10(2)7-9)6-4-11(12)8-14/h9-11,14H,3-8,12H2,1-2H3
InChIKeyJIGNTGLNHZMTQV-UHFFFAOYSA-N
XLogP0.82
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(2-methylpyrrolidin-1-yl)butan-1-ol
CID 64791163
3-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol
CID 64899218
6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine
CID 106799729
4-(2,4-dimethylpiperidin-1-yl)-2-ethylbutan-1-amine
CID 81080026
5-(2,4-dimethylpiperidin-1-yl)pentan-2-ol
CID 62330381
4-(2,4-dimethylpiperidin-1-yl)-N-methylbutan-2-amine
CID 62330145
1-(2,4-dimethylpiperidin-1-yl)propan-2-amine
CID 62331948
1-(2,4-dimethylpiperidin-1-yl)-4-methylpentan-2-amine
CID 62330026
2-(cyclopropylamino)-4-(2,4-dimethylpiperidin-1-yl)butanenitrile
CID 63028154
1-(2-chlorophenyl)-3-(2,4-dimethylpiperidin-1-yl)propan-1-amine
CID 62644751
2-amino-5-(2,4-dimethylpiperidin-1-yl)-2-methylpentan-1-ol
CID 64787405
1-(3-chloropropyl)-2,4-dimethylpiperidine
CID 62332524

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol?
The IUPAC name of 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol (CID 64787601) is 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol.
What is the SMILES notation for 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol?
The canonical SMILES for 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol is CC1CCN(CCC(N)CO)C(C)C1.
What is the InChIKey of 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol?
The InChIKey is JIGNTGLNHZMTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9-3-5-13(10(2)7-9)6-4-11(12)8-14/h9-11,14H,3-8,12H2,1-2H3.
What are the key properties of 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol?
2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol has a molecular weight of 200.33 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2,4-dimethylpiperidin-1-yl)butan-1-ol is sourced from PubChem (CID 64787601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).