5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide

C18H15N5O3 — CID 146095823

IUPAC5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CC(=O)Nc2cnc(-c3cccc(O)c3)nc2)cn1
InChIInChI=1S/C18H15N5O3/c19-17(26)15-5-4-11(8-20-15)6-16(25)23-13-9-21-18(22-10-13)12-2-1-3-14(24)7-12/h1-5,7-10,24H,6H2,(H2,19,26)(H,23,25)
InChIKeySTBFFPVMQLXJIQ-UHFFFAOYSA-N
MW349.35 g/mol
LogP1.52
Rot. Bonds5

About 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide

5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide (PubChem CID 146095823) has the molecular formula C18H15N5O3 and a molecular weight of 349.35 g/mol. Its IUPAC name is 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide
PubChem CID146095823
Molecular FormulaC18H15N5O3
Molecular Weight349.35 g/mol
Exact Mass349.12
IUPAC Name5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CC(=O)Nc2cnc(-c3cccc(O)c3)nc2)cn1
InChIInChI=1S/C18H15N5O3/c19-17(26)15-5-4-11(8-20-15)6-16(25)23-13-9-21-18(22-10-13)12-2-1-3-14(24)7-12/h1-5,7-10,24H,6H2,(H2,19,26)(H,23,25)
InChIKeySTBFFPVMQLXJIQ-UHFFFAOYSA-N
XLogP1.52
TPSA131.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzyl N-[4-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-4-oxobutyl]carbamate
CID 56520901
3-[(2,5-dimethylphenyl)sulfonylamino]-N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]propanamide
CID 56520139
3-[(3-chlorophenyl)sulfonylamino]-N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]propanamide
CID 56519883
methyl 2-[6-(3-hydroxyphenyl)-3-pyridinyl]acetate
CID 166089309
N-(3-hydroxyphenyl)-2-(4-hydroxyphenyl)acetamide
CID 28878488
N-[4-(aminomethyl)phenyl]-2-(3-hydroxyphenyl)acetamide
CID 61399107
methyl 2-[4-chloro-2-(3-hydroxyphenyl)pyrimidin-5-yl]acetate
CID 117225365
2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide
CID 86912777
2-(3-hydroxyphenyl)-N-(1H-pyrazol-4-yl)acetamide
CID 61399438
2-(2-chlorophenyl)-N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]-1,3-thiazole-5-carboxamide
CID 56520770
N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
2-(3-hydroxyphenyl)-N-(4-hydroxyphenyl)acetamide
CID 61399458

Frequently Asked Questions

What is the IUPAC name of 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide?
The IUPAC name of 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide (CID 146095823) is 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide is NC(=O)c1ccc(CC(=O)Nc2cnc(-c3cccc(O)c3)nc2)cn1.
What is the InChIKey of 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide?
The InChIKey is STBFFPVMQLXJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O3/c19-17(26)15-5-4-11(8-20-15)6-16(25)23-13-9-21-18(22-10-13)12-2-1-3-14(24)7-12/h1-5,7-10,24H,6H2,(H2,19,26)(H,23,25).
What are the key properties of 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide?
5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide has a molecular weight of 349.35 g/mol, XLogP of 1.52, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[[2-(3-hydroxyphenyl)pyrimidin-5-yl]amino]-2-oxoethyl]pyridine-2-carboxamide is sourced from PubChem (CID 146095823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).