3-amino-3H-pyridin-2-one;molecular hydrogen;propane

C8H16N2O — CID 144662801

IUPAC3-amino-3H-pyridin-2-one;molecular hydrogen;propane
SMILESCCC.NC1C=CC=NC1=O.[H][H]
InChIInChI=1S/C5H6N2O.C3H8.H2/c6-4-2-1-3-7-5(4)8;1-3-2;/h1-4H,6H2;3H2,1-2H3;1H
InChIKeyNRTNJSNPAROGJY-UHFFFAOYSA-N
MW156.23 g/mol
LogP1.14
Rot. Bonds

About 3-amino-3H-pyridin-2-one;molecular hydrogen;propane

3-amino-3H-pyridin-2-one;molecular hydrogen;propane (PubChem CID 144662801) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 3-amino-3H-pyridin-2-one;molecular hydrogen;propane.

Molecular Properties

Compound Name3-amino-3H-pyridin-2-one;molecular hydrogen;propane
PubChem CID144662801
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name3-amino-3H-pyridin-2-one;molecular hydrogen;propane
SMILESCCC.NC1C=CC=NC1=O.[H][H]
InChIInChI=1S/C5H6N2O.C3H8.H2/c6-4-2-1-3-7-5(4)8;1-3-2;/h1-4H,6H2;3H2,1-2H3;1H
InChIKeyNRTNJSNPAROGJY-UHFFFAOYSA-N
XLogP1.14
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3H-pyridin-2-one;molecular hydrogen;propane?
The IUPAC name of 3-amino-3H-pyridin-2-one;molecular hydrogen;propane (CID 144662801) is 3-amino-3H-pyridin-2-one;molecular hydrogen;propane.
What is the SMILES notation for 3-amino-3H-pyridin-2-one;molecular hydrogen;propane?
The canonical SMILES for 3-amino-3H-pyridin-2-one;molecular hydrogen;propane is CCC.NC1C=CC=NC1=O.[H][H].
What is the InChIKey of 3-amino-3H-pyridin-2-one;molecular hydrogen;propane?
The InChIKey is NRTNJSNPAROGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O.C3H8.H2/c6-4-2-1-3-7-5(4)8;1-3-2;/h1-4H,6H2;3H2,1-2H3;1H.
What are the key properties of 3-amino-3H-pyridin-2-one;molecular hydrogen;propane?
3-amino-3H-pyridin-2-one;molecular hydrogen;propane has a molecular weight of 156.23 g/mol, XLogP of 1.14, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3H-pyridin-2-one;molecular hydrogen;propane is sourced from PubChem (CID 144662801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).