3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol

C10H16N2O — CID 84657502

IUPAC3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol
SMILESCc1nccc(C(N)CCO)c1C
InChIInChI=1S/C10H16N2O/c1-7-8(2)12-5-3-9(7)10(11)4-6-13/h3,5,10,13H,4,6,11H2,1-2H3
InChIKeyYMNMIRAHEQDEGW-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.08
Rot. Bonds3

About 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol

3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol (PubChem CID 84657502) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol.

Molecular Properties

Compound Name3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol
PubChem CID84657502
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol
SMILESCc1nccc(C(N)CCO)c1C
InChIInChI=1S/C10H16N2O/c1-7-8(2)12-5-3-9(7)10(11)4-6-13/h3,5,10,13H,4,6,11H2,1-2H3
InChIKeyYMNMIRAHEQDEGW-UHFFFAOYSA-N
XLogP1.08
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-3-(2,3-dimethyl-4-pyridinyl)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

(3R)-3-amino-3-(3-bromo-2-chloro-4-pyridinyl)propan-1-ol
CID 130736600
(3S)-3-amino-3-(3-chloro-2-methylphenyl)propan-1-ol
CID 55272388
3-amino-3-(3-methoxy-2-methylphenyl)propan-1-ol
CID 83830990
3-amino-3-(3-amino-4-pyridinyl)propan-1-ol
CID 55292643
3-amino-3-(6-methoxy-2-methyl-3-pyridinyl)propan-1-ol
CID 55269648
(3R)-3-amino-3-(2-amino-3-pyridinyl)propan-1-ol;hydrochloride
CID 171211346
4-amino-3-(2,3-dimethyl-4-pyridinyl)butanoic acid
CID 84676112
3-amino-3-(4-methylnaphthalen-1-yl)propan-1-ol;hydrochloride
CID 170874773
(2S)-2-amino-2-(2-methyl-3-pyridinyl)ethanol
CID 55263472
(3R)-3-amino-3-(2-amino-4-pyridinyl)propan-1-ol
CID 55293388
4-[(1S)-1-amino-3-hydroxypropyl]pyridine-3-carboxylic acid
CID 55269515
3-amino-3-(3-fluoro-2,5-dimethylphenyl)propan-1-ol
CID 84774435

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol?
The IUPAC name of 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol (CID 84657502) is 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol.
What is the SMILES notation for 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol?
The canonical SMILES for 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol is Cc1nccc(C(N)CCO)c1C.
What is the InChIKey of 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol?
The InChIKey is YMNMIRAHEQDEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7-8(2)12-5-3-9(7)10(11)4-6-13/h3,5,10,13H,4,6,11H2,1-2H3.
What are the key properties of 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol?
3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-(2,3-dimethyl-4-pyridinyl)propan-1-ol is sourced from PubChem (CID 84657502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).