3-(methylamino)-2-pyridin-4-ylpropan-1-ol

C9H14N2O — CID 117246508

IUPAC3-(methylamino)-2-pyridin-4-ylpropan-1-ol
SMILESCNCC(CO)c1ccncc1
InChIInChI=1S/C9H14N2O/c1-10-6-9(7-12)8-2-4-11-5-3-8/h2-5,9-10,12H,6-7H2,1H3
InChIKeyFEHAQVQYHFNVIG-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.38
Rot. Bonds4

About 3-(methylamino)-2-pyridin-4-ylpropan-1-ol

3-(methylamino)-2-pyridin-4-ylpropan-1-ol (PubChem CID 117246508) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 3-(methylamino)-2-pyridin-4-ylpropan-1-ol.

Molecular Properties

Compound Name3-(methylamino)-2-pyridin-4-ylpropan-1-ol
PubChem CID117246508
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name3-(methylamino)-2-pyridin-4-ylpropan-1-ol
SMILESCNCC(CO)c1ccncc1
InChIInChI=1S/C9H14N2O/c1-10-6-9(7-12)8-2-4-11-5-3-8/h2-5,9-10,12H,6-7H2,1H3
InChIKeyFEHAQVQYHFNVIG-UHFFFAOYSA-N
XLogP0.38
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-pyridin-4-ylpentan-1-amine
CID 116824893
N-methyl-2,2-dipyridin-4-ylethanamine
CID 116824958
3-(dimethylamino)-2-pyridin-4-ylpropan-1-ol
CID 117246509
2-fluoro-N-methyl-2-pyridin-4-ylethanamine
CID 83853523
3-(methylamino)-2-(4-phenoxyphenyl)propan-1-ol
CID 116835477
3-(methylamino)-2-thiophen-2-ylpropan-1-ol
CID 117240343
N-(3-hydroxy-2-phenylpropyl)-2-(methylamino)acetamide
CID 120704917
zinc tetrakis(4-pentan-3-ylpyridine)
CID 50909730
4-(1-chlorobutan-2-yl)pyridine
CID 141093425
(2S)-2-[[(1R)-1-pyridin-4-ylethyl]amino]propan-1-ol
CID 93082825
N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine
CID 116824934
3-(2-methylpropylamino)-2-phenylpropan-1-ol
CID 115876691

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-2-pyridin-4-ylpropan-1-ol?
The IUPAC name of 3-(methylamino)-2-pyridin-4-ylpropan-1-ol (CID 117246508) is 3-(methylamino)-2-pyridin-4-ylpropan-1-ol.
What is the SMILES notation for 3-(methylamino)-2-pyridin-4-ylpropan-1-ol?
The canonical SMILES for 3-(methylamino)-2-pyridin-4-ylpropan-1-ol is CNCC(CO)c1ccncc1.
What is the InChIKey of 3-(methylamino)-2-pyridin-4-ylpropan-1-ol?
The InChIKey is FEHAQVQYHFNVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-10-6-9(7-12)8-2-4-11-5-3-8/h2-5,9-10,12H,6-7H2,1H3.
What are the key properties of 3-(methylamino)-2-pyridin-4-ylpropan-1-ol?
3-(methylamino)-2-pyridin-4-ylpropan-1-ol has a molecular weight of 166.22 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-2-pyridin-4-ylpropan-1-ol is sourced from PubChem (CID 117246508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).