6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol

C10H16N2O2 — CID 79776129

IUPAC6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol
SMILESCCC(CO)NCc1ccc(O)cn1
InChIInChI=1S/C10H16N2O2/c1-2-8(7-13)11-5-9-3-4-10(14)6-12-9/h3-4,6,8,11,13-14H,2,5,7H2,1H3
InChIKeySEMUTQWGULXLBE-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.65
Rot. Bonds5

About 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol

6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol (PubChem CID 79776129) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol
PubChem CID79776129
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol
SMILESCCC(CO)NCc1ccc(O)cn1
InChIInChI=1S/C10H16N2O2/c1-2-8(7-13)11-5-9-3-4-10(14)6-12-9/h3-4,6,8,11,13-14H,2,5,7H2,1H3
InChIKeySEMUTQWGULXLBE-UHFFFAOYSA-N
XLogP0.65
TPSA65.38 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(hexan-3-ylamino)methyl]pyridin-3-ol
CID 79784062
6-[(3-methylpentan-2-ylamino)methyl]pyridin-3-ol
CID 79781532
6-[(4-methylhexan-2-ylamino)methyl]pyridin-3-ol
CID 79794471
(2R)-2-(pyrimidin-4-ylmethylamino)butan-1-ol
CID 104868735
6-[(1-thiophen-2-ylpropylamino)methyl]pyridin-3-ol
CID 79782907
6-[(1-cyclohexylpropylamino)methyl]pyridin-3-ol
CID 79793819
2-[(5-hydroxy-2-pyridinyl)methylamino]-N-methylpropanamide
CID 79782389
(2S)-2-[(6-methyl-3-pyridinyl)methylamino]butan-1-ol
CID 104980540
2-[[[(2R)-1-hydroxybutan-2-yl]amino]methyl]phenol
CID 15278079
6-[[[(1S)-1-pyridin-2-ylethyl]amino]methyl]pyridin-3-ol
CID 81402421
6-[[[(1R)-1-pyridin-2-ylethyl]amino]methyl]pyridin-3-ol
CID 81402144
6-[[[(1R)-1-pyridin-3-ylethyl]amino]methyl]pyridin-3-ol
CID 81405183

Frequently Asked Questions

What is the IUPAC name of 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol?
The IUPAC name of 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol (CID 79776129) is 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol.
What is the SMILES notation for 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol?
The canonical SMILES for 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol is CCC(CO)NCc1ccc(O)cn1.
What is the InChIKey of 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol?
The InChIKey is SEMUTQWGULXLBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-2-8(7-13)11-5-9-3-4-10(14)6-12-9/h3-4,6,8,11,13-14H,2,5,7H2,1H3.
What are the key properties of 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol?
6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol has a molecular weight of 196.25 g/mol, XLogP of 0.65, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-hydroxybutan-2-ylamino)methyl]pyridin-3-ol is sourced from PubChem (CID 79776129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).