3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one

C7H10N2O2 — CID 133060755

IUPAC3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one
SMILESCC(N)c1cc(O)c[nH]c1=O
InChIInChI=1S/C7H10N2O2/c1-4(8)6-2-5(10)3-9-7(6)11/h2-4,10H,8H2,1H3,(H,9,11)
InChIKeyITVMNJWVMJITOW-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.10
Rot. Bonds1

About 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one

3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one (PubChem CID 133060755) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one
PubChem CID133060755
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one
SMILESCC(N)c1cc(O)c[nH]c1=O
InChIInChI=1S/C7H10N2O2/c1-4(8)6-2-5(10)3-9-7(6)11/h2-4,10H,8H2,1H3,(H,9,11)
InChIKeyITVMNJWVMJITOW-UHFFFAOYSA-N
XLogP0.10
TPSA79.11 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(1R)-1-aminoethyl]-1H-pyridin-2-one
CID 55263461
3-(1-aminoethyl)-1H-pyridin-2-one
CID 12982899
5-(1-aminoethyl)-2-sulfanylidene-1H-pyrimidin-4-one
CID 87997783
5-hydroxy-2-oxo-1H-pyridine-3-carbaldehyde
CID 133056008
3-[(1R)-1-amino-2,2-dimethylpropyl]-5-chloro-1H-pyridin-2-one
CID 130649424
3-[(1S)-1-aminopropyl]-5-nitro-1H-pyridin-2-one
CID 130644884
3-[(1R)-1-aminoethyl]-4-methoxyphenol
CID 131197518
5-(1-aminoethyl)-8-hydroxy-1H-quinolin-2-one;hydrochloride
CID 70411670
3-amino-5-propan-2-yl-1H-pyridin-2-one
CID 105429770
5-(1-aminoethyl)-1H-pyridin-2-one;hydrochloride
CID 105435949
3-(dihydroxymethyl)-5-nitro-1H-pyridin-2-one
CID 118586009
3-[(1R)-1-(methylamino)ethyl]-5-nitro-1H-pyridin-2-one
CID 131140729

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one?
The IUPAC name of 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one (CID 133060755) is 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one.
What is the SMILES notation for 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one?
The canonical SMILES for 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one is CC(N)c1cc(O)c[nH]c1=O.
What is the InChIKey of 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one?
The InChIKey is ITVMNJWVMJITOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-4(8)6-2-5(10)3-9-7(6)11/h2-4,10H,8H2,1H3,(H,9,11).
What are the key properties of 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one?
3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one has a molecular weight of 154.17 g/mol, XLogP of 0.10, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminoethyl)-5-hydroxy-1H-pyridin-2-one is sourced from PubChem (CID 133060755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).