1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol

C9H16N2O — CID 19041110

IUPAC1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol
SMILESCN(C)CC(O)C1C=CC=CN1
InChIInChI=1S/C9H16N2O/c1-11(2)7-9(12)8-5-3-4-6-10-8/h3-6,8-10,12H,7H2,1-2H3
InChIKeyODZGBIRLQZDDMO-UHFFFAOYSA-N
MW168.24 g/mol
LogP-0.05
Rot. Bonds3

About 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol

1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol (PubChem CID 19041110) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol.

Molecular Properties

Compound Name1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol
PubChem CID19041110
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol
SMILESCN(C)CC(O)C1C=CC=CN1
InChIInChI=1S/C9H16N2O/c1-11(2)7-9(12)8-5-3-4-6-10-8/h3-6,8-10,12H,7H2,1-2H3
InChIKeyODZGBIRLQZDDMO-UHFFFAOYSA-N
XLogP-0.05
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,2-Dihydropyridin-2-yl)-2,2-difluoropropan-1-ol
CID 175731867
1-(1,2-Dihydropyridin-2-yl)-2-(4-methylpiperazin-1-yl)ethanol
CID 19041070
2-(1,2-Dihydropyridin-2-yl)-2-(dimethylamino)ethanol
CID 19041118
(E)-5-(dimethylamino)-3-(methylamino)oct-6-en-4-ol
CID 59728819
2-[2-(1,2-Dihydropyridin-2-yl)ethylamino]ethanol
CID 67600219
1-[2-(methylamino)-1H-pyridin-2-yl]ethanol
CID 70097916
6-Amino-3-[methyl-[3-[methyl(propyl)amino]propyl]amino]cyclohexa-2,4-dien-1-ol
CID 118300642
1-(2-ethenyl-1H-pyridin-2-yl)ethanol
CID 118481955
1-[2-(aminomethyl)-2H-pyridin-1-yl]propan-2-ol
CID 141799570
[1-methyl-5-(methylamino)-2H-pyridin-2-yl]methanol
CID 156424179
(2S,4Z,7Z)-1-(ethenylamino)deca-4,7-dien-2-ol
CID 163537540
1-amino-3-[[(E)-3-(cyclohexa-1,3-dien-1-ylamino)-2-methylbut-2-enyl]-ethylamino]propan-2-ol
CID 167055835

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol?
The IUPAC name of 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol (CID 19041110) is 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol.
What is the SMILES notation for 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol?
The canonical SMILES for 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol is CN(C)CC(O)C1C=CC=CN1.
What is the InChIKey of 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol?
The InChIKey is ODZGBIRLQZDDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-11(2)7-9(12)8-5-3-4-6-10-8/h3-6,8-10,12H,7H2,1-2H3.
What are the key properties of 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol?
1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol has a molecular weight of 168.24 g/mol, XLogP of -0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dihydropyridin-2-yl)-2-(dimethylamino)ethanol is sourced from PubChem (CID 19041110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).