(2-carbamoylphenyl) N-naphthalen-1-ylcarbamate

C18H14N2O3 — CID 4121359

IUPAC(2-carbamoylphenyl) N-naphthalen-1-ylcarbamate
SMILESNC(=O)c1ccccc1OC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C18H14N2O3/c19-17(21)14-9-3-4-11-16(14)23-18(22)20-15-10-5-7-12-6-1-2-8-13(12)15/h1-11H,(H2,19,21)(H,20,22)
InChIKeyMEXJPADWZOGFPW-UHFFFAOYSA-N
MW306.32 g/mol
LogP3.55
Rot. Bonds3

About (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate

(2-carbamoylphenyl) N-naphthalen-1-ylcarbamate (PubChem CID 4121359) has the molecular formula C18H14N2O3 and a molecular weight of 306.32 g/mol. Its IUPAC name is (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate.

Molecular Properties

Compound Name(2-carbamoylphenyl) N-naphthalen-1-ylcarbamate
PubChem CID4121359
Molecular FormulaC18H14N2O3
Molecular Weight306.32 g/mol
Exact Mass306.10
IUPAC Name(2-carbamoylphenyl) N-naphthalen-1-ylcarbamate
SMILESNC(=O)c1ccccc1OC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C18H14N2O3/c19-17(21)14-9-3-4-11-16(14)23-18(22)20-15-10-5-7-12-6-1-2-8-13(12)15/h1-11H,(H2,19,21)(H,20,22)
InChIKeyMEXJPADWZOGFPW-UHFFFAOYSA-N
XLogP3.55
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

naphthalen-1-ylurea;hydrochloride
CID 141142203
1,1-difluoro-2-[2-(naphthalen-1-ylcarbamoyl)phenoxy]-2-oxoethanesulfonic acid
CID 177295076
[(E)-[(3E)-3-(naphthalen-1-ylcarbamoyloxyimino)butan-2-ylidene]amino] N-naphthalen-1-ylcarbamate
CID 43835675
CID 129133768
CID 129133768
2-(3-naphthalen-1-ylpropanoylamino)benzamide
CID 53278686
(N'-naphthalen-1-ylcarbamimidoyl) N-naphthalen-1-ylcarbamate
CID 68502667
3-amino-2-(naphthalen-1-ylamino)benzamide
CID 115933816
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
(2-carbamoylphenyl) hydrogen carbonate
CID 91199327
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643
1-(3-amino-3-sulfanylidenepropyl)-3-naphthalen-1-ylurea
CID 62667648

Frequently Asked Questions

What is the IUPAC name of (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate?
The IUPAC name of (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate (CID 4121359) is (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate.
What is the SMILES notation for (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate?
The canonical SMILES for (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate is NC(=O)c1ccccc1OC(=O)Nc1cccc2ccccc12.
What is the InChIKey of (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate?
The InChIKey is MEXJPADWZOGFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O3/c19-17(21)14-9-3-4-11-16(14)23-18(22)20-15-10-5-7-12-6-1-2-8-13(12)15/h1-11H,(H2,19,21)(H,20,22).
What are the key properties of (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate?
(2-carbamoylphenyl) N-naphthalen-1-ylcarbamate has a molecular weight of 306.32 g/mol, XLogP of 3.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-carbamoylphenyl) N-naphthalen-1-ylcarbamate is sourced from PubChem (CID 4121359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).