(6-methyl-1,2-dihydropyridin-2-yl)methanol

C7H11NO — CID 19807256

IUPAC(6-methyl-1,2-dihydropyridin-2-yl)methanol
SMILESCC1=CC=CC(CO)N1
InChIInChI=1S/C7H11NO/c1-6-3-2-4-7(5-9)8-6/h2-4,7-9H,5H2,1H3
InChIKeyXRHREIMFACYFBH-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.41
Rot. Bonds1

About (6-methyl-1,2-dihydropyridin-2-yl)methanol

(6-methyl-1,2-dihydropyridin-2-yl)methanol (PubChem CID 19807256) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is (6-methyl-1,2-dihydropyridin-2-yl)methanol.

Molecular Properties

Compound Name(6-methyl-1,2-dihydropyridin-2-yl)methanol
PubChem CID19807256
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name(6-methyl-1,2-dihydropyridin-2-yl)methanol
SMILESCC1=CC=CC(CO)N1
InChIInChI=1S/C7H11NO/c1-6-3-2-4-7(5-9)8-6/h2-4,7-9H,5H2,1H3
InChIKeyXRHREIMFACYFBH-UHFFFAOYSA-N
XLogP0.41
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dihydro-1H-pyrrol-2-ylmethanol
CID 51072180
CID 134953694
CID 134953694
CID 134967224
CID 134967224
CID 138966132
CID 138966132
[6-(Hydroxymethyl)-1,2-dihydropyridin-2-yl]methanol
CID 5246439
1,2-Dihydropyridin-2-ylmethanol
CID 5255583
2-(Cyclohexa-1,5-dien-1-ylamino)ethanol
CID 21477241
2-[(5-Aminocyclohexa-1,3-dien-1-yl)amino]ethanol
CID 21525076
[(2R)-2,5-dihydro-1H-pyrrol-2-yl]methanol
CID 52376249
[(2S)-2,5-dihydro-1H-pyrrol-2-yl]methanol
CID 52376251
2-(1,2-Dihydropyridin-6-yl)ethanol
CID 67962663
(2,6-dimethyl-1H-pyridin-2-yl)methanol
CID 70247251

Frequently Asked Questions

What is the IUPAC name of (6-methyl-1,2-dihydropyridin-2-yl)methanol?
The IUPAC name of (6-methyl-1,2-dihydropyridin-2-yl)methanol (CID 19807256) is (6-methyl-1,2-dihydropyridin-2-yl)methanol.
What is the SMILES notation for (6-methyl-1,2-dihydropyridin-2-yl)methanol?
The canonical SMILES for (6-methyl-1,2-dihydropyridin-2-yl)methanol is CC1=CC=CC(CO)N1.
What is the InChIKey of (6-methyl-1,2-dihydropyridin-2-yl)methanol?
The InChIKey is XRHREIMFACYFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-6-3-2-4-7(5-9)8-6/h2-4,7-9H,5H2,1H3.
What are the key properties of (6-methyl-1,2-dihydropyridin-2-yl)methanol?
(6-methyl-1,2-dihydropyridin-2-yl)methanol has a molecular weight of 125.17 g/mol, XLogP of 0.41, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-1,2-dihydropyridin-2-yl)methanol is sourced from PubChem (CID 19807256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).