benzyl N-(3-methoxynaphthalen-1-yl)carbamate

C19H17NO3 — CID 23023062

IUPACbenzyl N-(3-methoxynaphthalen-1-yl)carbamate
SMILESCOc1cc(NC(=O)OCc2ccccc2)c2ccccc2c1
InChIInChI=1S/C19H17NO3/c1-22-16-11-15-9-5-6-10-17(15)18(12-16)20-19(21)23-13-14-7-3-2-4-8-14/h2-12H,13H2,1H3,(H,20,21)
InChIKeyLBYIJJNIZCEDSK-UHFFFAOYSA-N
MW307.35 g/mol
LogP4.60
Rot. Bonds4

About benzyl N-(3-methoxynaphthalen-1-yl)carbamate

benzyl N-(3-methoxynaphthalen-1-yl)carbamate (PubChem CID 23023062) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is benzyl N-(3-methoxynaphthalen-1-yl)carbamate.

Molecular Properties

Compound Namebenzyl N-(3-methoxynaphthalen-1-yl)carbamate
PubChem CID23023062
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Namebenzyl N-(3-methoxynaphthalen-1-yl)carbamate
SMILESCOc1cc(NC(=O)OCc2ccccc2)c2ccccc2c1
InChIInChI=1S/C19H17NO3/c1-22-16-11-15-9-5-6-10-17(15)18(12-16)20-19(21)23-13-14-7-3-2-4-8-14/h2-12H,13H2,1H3,(H,20,21)
InChIKeyLBYIJJNIZCEDSK-UHFFFAOYSA-N
XLogP4.60
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl N-[3-tert-butyl-5-methoxy-2-(methoxymethoxy)phenyl]carbamate
CID 139748839
benzyl N-[2-(2-aminonaphthalen-1-yl)-4-methoxyphenyl]carbamate
CID 53343709
benzyl N-[2-formyl-5-methoxy-3-(methoxymethoxy)phenyl]carbamate
CID 88935941
benzyl N-[4-(4-methoxyphenyl)phenyl]carbamate
CID 102104858
3-methoxy-5-(phenylmethoxycarbonylamino)benzoic acid
CID 68546183
benzyl N-[2-(2-aminonaphthalen-1-yl)-3-methoxyphenyl]carbamate
CID 53344092
benzyl N-[(3-methoxyphenyl)methyl]carbamate
CID 110779928
benzyl N-(2,5-dimethoxyanilino)carbamate
CID 141011379
benzyl N-(2-carbamoyl-4,6-dimethoxyphenyl)carbamate
CID 70300379
benzyl N-[5-(hydroxyamino)-2-methoxyphenyl]carbamate
CID 142143785
[4-ethyl-3-(phenylmethoxycarbonylamino)phenyl] acetate
CID 67136159
benzyl N-(7-methoxy-4-oxo-1H-quinolin-6-yl)carbamate
CID 58931364

Frequently Asked Questions

What is the IUPAC name of benzyl N-(3-methoxynaphthalen-1-yl)carbamate?
The IUPAC name of benzyl N-(3-methoxynaphthalen-1-yl)carbamate (CID 23023062) is benzyl N-(3-methoxynaphthalen-1-yl)carbamate.
What is the SMILES notation for benzyl N-(3-methoxynaphthalen-1-yl)carbamate?
The canonical SMILES for benzyl N-(3-methoxynaphthalen-1-yl)carbamate is COc1cc(NC(=O)OCc2ccccc2)c2ccccc2c1.
What is the InChIKey of benzyl N-(3-methoxynaphthalen-1-yl)carbamate?
The InChIKey is LBYIJJNIZCEDSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c1-22-16-11-15-9-5-6-10-17(15)18(12-16)20-19(21)23-13-14-7-3-2-4-8-14/h2-12H,13H2,1H3,(H,20,21).
What are the key properties of benzyl N-(3-methoxynaphthalen-1-yl)carbamate?
benzyl N-(3-methoxynaphthalen-1-yl)carbamate has a molecular weight of 307.35 g/mol, XLogP of 4.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(3-methoxynaphthalen-1-yl)carbamate is sourced from PubChem (CID 23023062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).