propyl N-(4-phenylmethoxyphenyl)carbamate

C17H19NO3 — CID 19169909

IUPACpropyl N-(4-phenylmethoxyphenyl)carbamate
SMILESCCCOC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C17H19NO3/c1-2-12-20-17(19)18-15-8-10-16(11-9-15)21-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,18,19)
InChIKeyTYNCSMCCAIBEQF-UHFFFAOYSA-N
MW285.34 g/mol
LogP4.22
Rot. Bonds6

About propyl N-(4-phenylmethoxyphenyl)carbamate

propyl N-(4-phenylmethoxyphenyl)carbamate (PubChem CID 19169909) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is propyl N-(4-phenylmethoxyphenyl)carbamate.

Molecular Properties

Compound Namepropyl N-(4-phenylmethoxyphenyl)carbamate
PubChem CID19169909
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Namepropyl N-(4-phenylmethoxyphenyl)carbamate
SMILESCCCOC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C17H19NO3/c1-2-12-20-17(19)18-15-8-10-16(11-9-15)21-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,18,19)
InChIKeyTYNCSMCCAIBEQF-UHFFFAOYSA-N
XLogP4.22
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

propyl 4-[[2-(4-phenylmethoxyanilino)acetyl]amino]benzoate
CID 54822023
2-amino-N-(4-phenylmethoxyphenyl)pentanamide;hydrochloride
CID 119261538
[4-(propoxycarbonylamino)phenyl]carbamic acid
CID 70130219
2-hydroxyethyl N-(4-propoxyphenyl)carbamate
CID 79348792
4-[(4-butoxyphenyl)carbamoyloxy]butyl N-(4-butoxyphenyl)carbamate
CID 122381911
4-heptoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 4950725
ethyl N-[6-(4-phenylmethoxyanilino)-3-pyridinyl]carbamate
CID 113021244
benzyl N-(4-prop-2-enoxyphenyl)carbamate
CID 4952532
1-phenylmethoxy-4-propoxybenzene
CID 10728874
N-(4-phenylmethoxyphenyl)-N',N'-dipropyloxamide
CID 108986506
N-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]butanamide
CID 113000427
ethyl 4-oxo-4-(4-phenylmethoxyanilino)butanoate
CID 4947468

Frequently Asked Questions

What is the IUPAC name of propyl N-(4-phenylmethoxyphenyl)carbamate?
The IUPAC name of propyl N-(4-phenylmethoxyphenyl)carbamate (CID 19169909) is propyl N-(4-phenylmethoxyphenyl)carbamate.
What is the SMILES notation for propyl N-(4-phenylmethoxyphenyl)carbamate?
The canonical SMILES for propyl N-(4-phenylmethoxyphenyl)carbamate is CCCOC(=O)Nc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of propyl N-(4-phenylmethoxyphenyl)carbamate?
The InChIKey is TYNCSMCCAIBEQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-2-12-20-17(19)18-15-8-10-16(11-9-15)21-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H,18,19).
What are the key properties of propyl N-(4-phenylmethoxyphenyl)carbamate?
propyl N-(4-phenylmethoxyphenyl)carbamate has a molecular weight of 285.34 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propyl N-(4-phenylmethoxyphenyl)carbamate is sourced from PubChem (CID 19169909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).