1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea

C19H18N2O2 — CID 70896646

IUPAC1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea
SMILESCOc1cc2ccccc2cc1N(C(N)=O)c1ccc(C)cc1
InChIInChI=1S/C19H18N2O2/c1-13-7-9-16(10-8-13)21(19(20)22)17-11-14-5-3-4-6-15(14)12-18(17)23-2/h3-12H,1-2H3,(H2,20,22)
InChIKeyQYKJTHQDHWLWIC-UHFFFAOYSA-N
MW306.37 g/mol
LogP4.37
Rot. Bonds3

About 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea

1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea (PubChem CID 70896646) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea.

Molecular Properties

Compound Name1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea
PubChem CID70896646
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea
SMILESCOc1cc2ccccc2cc1N(C(N)=O)c1ccc(C)cc1
InChIInChI=1S/C19H18N2O2/c1-13-7-9-16(10-8-13)21(19(20)22)17-11-14-5-3-4-6-15(14)12-18(17)23-2/h3-12H,1-2H3,(H2,20,22)
InChIKeyQYKJTHQDHWLWIC-UHFFFAOYSA-N
XLogP4.37
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methoxynaphthalen-2-yl)-N-methylnitrous amide
CID 102585032
2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide
CID 71171207
3,5-diamino-N-(4-methylphenyl)-N-naphthalen-2-ylbenzamide
CID 1240167
N-(2,4-dimethoxyphenyl)-N-phenylacetamide
CID 101328675
N,N-bis(4-methoxyphenyl)naphthalene-2-carboxamide
CID 129035097
1-[5-(difluoromethylsulfonyl)-2-methoxyphenyl]-1-(4-fluorophenyl)urea
CID 70896464
1-methyl-1-(2,4,5-trimethoxyphenyl)urea
CID 115168286
CID 101146176
CID 101146176
2-(4-methoxyphenyl)-2-(4-methylphenyl)-2-phenylacetamide
CID 121405860
1-(5-tert-butyl-2-methoxyphenyl)-1-[4-(pyridin-4-ylmethyl)phenyl]urea
CID 70896703
3-methoxy-N-[(1R)-1-(4-methylphenyl)ethyl]naphthalene-2-carboxamide
CID 28633409
1,1-diphenylurea
CID 174849888

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea?
The IUPAC name of 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea (CID 70896646) is 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea.
What is the SMILES notation for 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea?
The canonical SMILES for 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea is COc1cc2ccccc2cc1N(C(N)=O)c1ccc(C)cc1.
What is the InChIKey of 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea?
The InChIKey is QYKJTHQDHWLWIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-13-7-9-16(10-8-13)21(19(20)22)17-11-14-5-3-4-6-15(14)12-18(17)23-2/h3-12H,1-2H3,(H2,20,22).
What are the key properties of 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea?
1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea has a molecular weight of 306.37 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea is sourced from PubChem (CID 70896646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).