1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea

C17H16N4O — CID 46947659

IUPAC1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2cc3cccnc3nc2C)cc1
InChIInChI=1S/C17H16N4O/c1-11-5-7-14(8-6-11)20-17(22)21-15-10-13-4-3-9-18-16(13)19-12(15)2/h3-10H,1-2H3,(H2,20,21,22)
InChIKeyGHASDXXZGRPYPU-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.89
Rot. Bonds2

About 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea

1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea (PubChem CID 46947659) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea.

Molecular Properties

Compound Name1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea
PubChem CID46947659
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2cc3cccnc3nc2C)cc1
InChIInChI=1S/C17H16N4O/c1-11-5-7-14(8-6-11)20-17(22)21-15-10-13-4-3-9-18-16(13)19-12(15)2/h3-10H,1-2H3,(H2,20,21,22)
InChIKeyGHASDXXZGRPYPU-UHFFFAOYSA-N
XLogP3.89
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea 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

1-(3-methoxyphenyl)-3-(2-methyl-1,8-naphthyridin-3-yl)urea
CID 46947661
(4-methylphenyl)methyl N-(2-methyl-1,8-naphthyridin-3-yl)carbamate
CID 11460974
butyl N-(2-methyl-1,8-naphthyridin-3-yl)carbamate
CID 11311488
1-(4-bromophenyl)-3-[5-[(4-bromophenyl)carbamoylamino]-2,6-dimethyl-3-pyridinyl]urea
CID 4860693
1-(2-chloro-4-methylphenyl)-3-(4-methylphenyl)urea
CID 46860275
1-(4-methylphenyl)-3-pyridin-3-ylurea
CID 790714
methyl 4-[[5-[(4-methoxycarbonylphenyl)carbamoylamino]-2,6-dimethyl-3-pyridinyl]carbamoylamino]benzoate
CID 23605079
N-(2-hydroxyphenyl)-2-methyl-1,8-naphthyridine-3-carboxamide
CID 11380444
1-(2,5-dimethylphenyl)-3-quinolin-8-ylurea
CID 48742637
1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 12560219
1-(2-chloro-4-hydroxyphenyl)-3-(4-methylphenyl)urea
CID 64787940
1-(3,5-dimethylphenyl)-3-(3-methyl-2-pyridinyl)urea
CID 6464451

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea?
The IUPAC name of 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea (CID 46947659) is 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea.
What is the SMILES notation for 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea?
The canonical SMILES for 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea is Cc1ccc(NC(=O)Nc2cc3cccnc3nc2C)cc1.
What is the InChIKey of 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea?
The InChIKey is GHASDXXZGRPYPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-11-5-7-14(8-6-11)20-17(22)21-15-10-13-4-3-9-18-16(13)19-12(15)2/h3-10H,1-2H3,(H2,20,21,22).
What are the key properties of 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea?
1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea has a molecular weight of 292.34 g/mol, XLogP of 3.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1,8-naphthyridin-3-yl)-3-(4-methylphenyl)urea is sourced from PubChem (CID 46947659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).