1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol

C9H14N2O2 — CID 55292838

IUPAC1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol
SMILESCOc1ncccc1C(N)C(C)O
InChIInChI=1S/C9H14N2O2/c1-6(12)8(10)7-4-3-5-11-9(7)13-2/h3-6,8,12H,10H2,1-2H3
InChIKeyJBMJRYFPNKSFFE-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.47
Rot. Bonds3

About 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol

1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol (PubChem CID 55292838) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol
PubChem CID55292838
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol
SMILESCOc1ncccc1C(N)C(C)O
InChIInChI=1S/C9H14N2O2/c1-6(12)8(10)7-4-3-5-11-9(7)13-2/h3-6,8,12H,10H2,1-2H3
InChIKeyJBMJRYFPNKSFFE-UHFFFAOYSA-N
XLogP0.47
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
CID 130961552
ethane;2-methoxy-3-propan-2-ylpyridine
CID 155741549
(1S,2S)-1-amino-1-(2-fluoro-3-pyridinyl)propan-2-ol
CID 55292775
1-amino-1-(2-methoxy-3-pyridinyl)propan-2-one
CID 55295483
2-methoxy-3-[(2R)-3-methylbutan-2-yl]pyridine
CID 176962095
(1S)-1-(2-methoxy-3-pyridinyl)prop-2-en-1-amine
CID 131218927
3-butan-2-yl-2-methoxypyridine
CID 130368185
(1R)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
CID 55276659
2,3-dihydroxy-3-(2-methoxy-3-pyridinyl)propanoic acid
CID 170823762
1-(2-methoxy-3-pyridinyl)-3-methylbut-2-en-1-ol
CID 105110251
(2-methoxy-3-pyridinyl)-(2-methylphenyl)methanamine
CID 105094474
1-amino-1-(2-methoxyphenyl)propan-2-ol;hydrochloride
CID 162343351

Frequently Asked Questions

What is the IUPAC name of 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol?
The IUPAC name of 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol (CID 55292838) is 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol.
What is the SMILES notation for 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol?
The canonical SMILES for 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol is COc1ncccc1C(N)C(C)O.
What is the InChIKey of 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol?
The InChIKey is JBMJRYFPNKSFFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-6(12)8(10)7-4-3-5-11-9(7)13-2/h3-6,8,12H,10H2,1-2H3.
What are the key properties of 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol?
1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol has a molecular weight of 182.22 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol is sourced from PubChem (CID 55292838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).