2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol

C10H16N2O — CID 89305217

IUPAC2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol
SMILESCc1ccc(CNC(C)CO)cn1
InChIInChI=1S/C10H16N2O/c1-8-3-4-10(5-11-8)6-12-9(2)7-13/h3-5,9,12-13H,6-7H2,1-2H3
InChIKeyKPWGNEZMKPHPMR-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.86
Rot. Bonds4

About 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol

2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol (PubChem CID 89305217) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol.

Molecular Properties

Compound Name2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol
PubChem CID89305217
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol
SMILESCc1ccc(CNC(C)CO)cn1
InChIInChI=1S/C10H16N2O/c1-8-3-4-10(5-11-8)6-12-9(2)7-13/h3-5,9,12-13H,6-7H2,1-2H3
InChIKeyKPWGNEZMKPHPMR-UHFFFAOYSA-N
XLogP0.86
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(6-methyl-3-pyridinyl)methylamino]butanenitrile
CID 62996928
(2S)-2-[(6-methyl-3-pyridinyl)methylamino]butan-1-ol
CID 104980540
1-N-ethyl-1-N-methyl-2-N-[(6-methyl-3-pyridinyl)methyl]propane-1,2-diamine
CID 103109827
2-[(2-methyl-4-pyridinyl)methylamino]propan-1-ol
CID 106752869
(1R)-1-cycloheptyl-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 113449658
(1R)-1-cyclohexyl-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 94912990
4,4-dimethyl-3-[(6-methyl-3-pyridinyl)methylamino]pentan-1-ol
CID 114176802
N'-hydroxy-2-[(6-methyl-3-pyridinyl)methylamino]propanimidamide
CID 77032579
2-methyl-3-(6-methyl-3-pyridinyl)propan-1-ol
CID 64666706
N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide
CID 62997286
4-[(1-hydroxypropan-2-ylamino)methyl]phenol
CID 43499774
2-methyl-N-[(6-methyl-3-pyridinyl)methyl]-1-phenylpropan-1-amine
CID 62996333

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol?
The IUPAC name of 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol (CID 89305217) is 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol.
What is the SMILES notation for 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol?
The canonical SMILES for 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol is Cc1ccc(CNC(C)CO)cn1.
What is the InChIKey of 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol?
The InChIKey is KPWGNEZMKPHPMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8-3-4-10(5-11-8)6-12-9(2)7-13/h3-5,9,12-13H,6-7H2,1-2H3.
What are the key properties of 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol?
2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol is sourced from PubChem (CID 89305217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).