3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol

C11H24N2O — CID 64789822

IUPAC3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
SMILESCNC(CO)CN1CCCC(C)(C)C1
InChIInChI=1S/C11H24N2O/c1-11(2)5-4-6-13(9-11)7-10(8-14)12-3/h10,12,14H,4-9H2,1-3H3
InChIKeyKJTDWHPCDWCULT-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.69
Rot. Bonds4

About 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol

3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol (PubChem CID 64789822) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol.

Molecular Properties

Compound Name3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
PubChem CID64789822
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
SMILESCNC(CO)CN1CCCC(C)(C)C1
InChIInChI=1S/C11H24N2O/c1-11(2)5-4-6-13(9-11)7-10(8-14)12-3/h10,12,14H,4-9H2,1-3H3
InChIKeyKJTDWHPCDWCULT-UHFFFAOYSA-N
XLogP0.69
TPSA35.50 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 ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-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

(2R)-1-(3,3-dimethylpiperidin-1-yl)propan-2-amine
CID 103934688
1-(3,3-dimethylazepan-1-yl)propan-2-ol
CID 131175747
1-cyclopentyl-2-(3,3-dimethylpyrrolidin-1-yl)-N-methylethanamine
CID 104746766
2-(methylamino)-3-(4-propan-2-ylpiperazin-1-yl)propan-1-ol
CID 64797303
2-(methylamino)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-ol
CID 64790156
1-(3,3-dimethylpiperidin-1-yl)-3-methylbutan-2-one
CID 79395843
2-(methylamino)-3-(2-methylmorpholin-4-yl)propan-1-ol
CID 64797801
1-[2-(azetidin-3-yl)propyl]-3,3-dimethylpiperidine
CID 116680106
4-(azocan-1-yl)-2-(methylamino)butan-1-ol
CID 64797115
3-(4-cyclopropylpiperazin-1-yl)-2-(methylamino)propan-1-ol
CID 64827046
1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine
CID 104746425
1-(2-fluoroethyl)-3,3-dimethylpiperidine
CID 131154120

Frequently Asked Questions

What is the IUPAC name of 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
The IUPAC name of 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol (CID 64789822) is 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol.
What is the SMILES notation for 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
The canonical SMILES for 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol is CNC(CO)CN1CCCC(C)(C)C1.
What is the InChIKey of 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
The InChIKey is KJTDWHPCDWCULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-11(2)5-4-6-13(9-11)7-10(8-14)12-3/h10,12,14H,4-9H2,1-3H3.
What are the key properties of 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol has a molecular weight of 200.33 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-ol is sourced from PubChem (CID 64789822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).