2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol

C11H16N2O — CID 115744703

IUPAC2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol
SMILESC=CCN(CCO)c1ccc(C)cn1
InChIInChI=1S/C11H16N2O/c1-3-6-13(7-8-14)11-5-4-10(2)9-12-11/h3-5,9,14H,1,6-8H2,2H3
InChIKeyNWVYRIITBPKEAN-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.37
Rot. Bonds5

About 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol

2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol (PubChem CID 115744703) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol.

Molecular Properties

Compound Name2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol
PubChem CID115744703
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol
SMILESC=CCN(CCO)c1ccc(C)cn1
InChIInChI=1S/C11H16N2O/c1-3-6-13(7-8-14)11-5-4-10(2)9-12-11/h3-5,9,14H,1,6-8H2,2H3
InChIKeyNWVYRIITBPKEAN-UHFFFAOYSA-N
XLogP1.37
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1R)-1-[6-[2-hydroxyethyl(prop-2-enyl)amino]-3-pyridinyl]ethanol
CID 104869570
2-[[5-[(1S)-1-aminoethyl]-2-pyridinyl]-prop-2-enylamino]ethanol
CID 104869537
2-[(5-bromo-4-methyl-2-pyridinyl)-prop-2-enylamino]ethanol
CID 75496488
2-[cyclopropyl-(5-methyl-2-pyridinyl)amino]ethanol
CID 61146522
2-[(5-methyl-2-pyridinyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621156
4-[2-hydroxyethyl(prop-2-enyl)amino]-2-methyl-1H-pyrimidin-6-one
CID 136979848
2-[prop-2-enyl-[6-(trifluoromethyl)pyridazin-3-yl]amino]ethanol
CID 115875659
2-[(5-iodopyrimidin-2-yl)-prop-2-enylamino]ethanol
CID 104843952
2-[(3-bromo-4-methyl-2-pyridinyl)-prop-2-enylamino]ethanol
CID 106876373
2-[[5-chloro-4-[(propan-2-ylamino)methyl]-2-pyridinyl]-prop-2-enylamino]ethanol
CID 114927139
6-[bis(prop-2-enyl)amino]pyridine-3-carbaldehyde
CID 80636417
5-[2-hydroxyethyl(prop-2-enyl)amino]pyridine-2-carbonitrile
CID 115744697

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol?
The IUPAC name of 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol (CID 115744703) is 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol.
What is the SMILES notation for 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol?
The canonical SMILES for 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol is C=CCN(CCO)c1ccc(C)cn1.
What is the InChIKey of 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol?
The InChIKey is NWVYRIITBPKEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-6-13(7-8-14)11-5-4-10(2)9-12-11/h3-5,9,14H,1,6-8H2,2H3.
What are the key properties of 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol?
2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol has a molecular weight of 192.26 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-2-pyridinyl)-prop-2-enylamino]ethanol is sourced from PubChem (CID 115744703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).