2-[(3-ethyl-2-pyridinyl)methylamino]ethanol

C10H16N2O — CID 82738095

IUPAC2-[(3-ethyl-2-pyridinyl)methylamino]ethanol
SMILESCCc1cccnc1CNCCO
InChIInChI=1S/C10H16N2O/c1-2-9-4-3-5-12-10(9)8-11-6-7-13/h3-5,11,13H,2,6-8H2,1H3
InChIKeyRWZNBQMEJPXCPS-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.73
Rot. Bonds5

About 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol

2-[(3-ethyl-2-pyridinyl)methylamino]ethanol (PubChem CID 82738095) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol.

Molecular Properties

Compound Name2-[(3-ethyl-2-pyridinyl)methylamino]ethanol
PubChem CID82738095
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-[(3-ethyl-2-pyridinyl)methylamino]ethanol
SMILESCCc1cccnc1CNCCO
InChIInChI=1S/C10H16N2O/c1-2-9-4-3-5-12-10(9)8-11-6-7-13/h3-5,11,13H,2,6-8H2,1H3
InChIKeyRWZNBQMEJPXCPS-UHFFFAOYSA-N
XLogP0.73
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(3-ethyl-2-pyridinyl)methyl]-3-methylbut-3-en-1-amine
CID 114472474
2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate
CID 82744779
2,3-diethylpyridine
CID 14747123
1-(3,5-dimethylphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82731760
1-(3-chloro-4-pyridinyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82737650
cobalt(2+);N-[[3-[(2,6-diethylanilino)methyl]-2-pyridinyl]methyl]-N'-(2,6-diethylphenyl)ethane-1,2-diamine;dichloride
CID 18441572
2-[(2-amino-3-pyridinyl)methylamino]ethanol
CID 82668213
1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82733206
N-[(3-ethyl-2-pyridinyl)methyl]-1-pyrazin-2-ylmethanamine
CID 82733194
1-(4-tert-butylcyclohexyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 104575269
N-[(3-ethyl-2-pyridinyl)methyl]-1-(1-methylpyrrol-3-yl)methanamine
CID 82732935
1-(azepan-1-yl)-2-[(3-ethyl-2-pyridinyl)methylamino]ethanone
CID 82738475

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol?
The IUPAC name of 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol (CID 82738095) is 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol.
What is the SMILES notation for 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol?
The canonical SMILES for 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol is CCc1cccnc1CNCCO.
What is the InChIKey of 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol?
The InChIKey is RWZNBQMEJPXCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-9-4-3-5-12-10(9)8-11-6-7-13/h3-5,11,13H,2,6-8H2,1H3.
What are the key properties of 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol?
2-[(3-ethyl-2-pyridinyl)methylamino]ethanol has a molecular weight of 180.25 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethyl-2-pyridinyl)methylamino]ethanol is sourced from PubChem (CID 82738095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).