1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol

C9H14N2O — CID 66271911

IUPAC1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol
SMILESCc1ccncc1C(C)(O)CN
InChIInChI=1S/C9H14N2O/c1-7-3-4-11-5-8(7)9(2,12)6-10/h3-5,12H,6,10H2,1-2H3
InChIKeyDSBIVWJVNIONHJ-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.56
Rot. Bonds2

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

1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol (PubChem CID 66271911) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol
PubChem CID66271911
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol
SMILESCc1ccncc1C(C)(O)CN
InChIInChI=1S/C9H14N2O/c1-7-3-4-11-5-8(7)9(2,12)6-10/h3-5,12H,6,10H2,1-2H3
InChIKeyDSBIVWJVNIONHJ-UHFFFAOYSA-N
XLogP0.56
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methyl-3-pyridinyl)butan-2-ol
CID 66273296
2-amino-2-(4-methyl-3-pyridinyl)propanoic acid
CID 55292841
2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine
CID 112757188
ethane;2-(3-methyl-4-pyridinyl)propan-2-ol
CID 145265708
4-amino-2-(3-fluoro-4-pyridinyl)butan-2-ol
CID 104739345
1-(3,4-dimethylphenyl)-1-(4-methyl-3-pyridinyl)ethanamine
CID 66274369
2-methyl-3-(4-methyl-3-pyridinyl)pentan-3-amine
CID 66274159
2-(aminomethyl)-2-ethyl-1-(4-methyl-3-pyridinyl)butan-1-one
CID 116603939
2-hydroxy-2-methyl-1-(4-methyl-3-pyridinyl)butan-1-one
CID 103446599
4-methyl-3-(6-methyldodecan-6-yl)pyridine
CID 134177281
2-(3-bromo-4-pyridinyl)-2-methylpropan-1-amine
CID 126980203
1-amino-3,3-dimethyl-2-(pyridin-3-ylmethyl)butan-2-ol
CID 104735827

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol?
The IUPAC name of 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol (CID 66271911) is 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol.
What is the SMILES notation for 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol?
The canonical SMILES for 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol is Cc1ccncc1C(C)(O)CN.
What is the InChIKey of 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol?
The InChIKey is DSBIVWJVNIONHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7-3-4-11-5-8(7)9(2,12)6-10/h3-5,12H,6,10H2,1-2H3.
What are the key properties of 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol?
1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol has a molecular weight of 166.22 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(4-methyl-3-pyridinyl)propan-2-ol is sourced from PubChem (CID 66271911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).