prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate

C15H14N2O3 — CID 110188366

IUPACprop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate
SMILESC=CCOC(=O)Nc1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C15H14N2O3/c1-2-10-19-15(18)17-12-5-7-13(8-6-12)20-14-4-3-9-16-11-14/h2-9,11H,1,10H2,(H,17,18)
InChIKeyRHHQONPWQXIJHF-UHFFFAOYSA-N
MW270.29 g/mol
LogP3.61
Rot. Bonds5

About prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate

prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate (PubChem CID 110188366) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate.

Molecular Properties

Compound Nameprop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate
PubChem CID110188366
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Nameprop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate
SMILESC=CCOC(=O)Nc1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C15H14N2O3/c1-2-10-19-15(18)17-12-5-7-13(8-6-12)20-14-4-3-9-16-11-14/h2-9,11H,1,10H2,(H,17,18)
InChIKeyRHHQONPWQXIJHF-UHFFFAOYSA-N
XLogP3.61
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(4-methoxyphenyl) N-(4-pyridin-3-yloxyphenyl)carbamate
CID 110188525
prop-2-enyl N-[4-[[4-(prop-2-enoxycarbonylamino)phenyl]methyl]phenyl]carbamate
CID 3455881
N-(4-pyridin-3-yloxyphenyl)cyclopentanecarboxamide
CID 154837757
5-phenoxy-2-(prop-2-enoxycarbonylamino)benzoic acid
CID 167736844
3,4-dimethoxy-N-(4-pyridin-3-yloxyphenyl)benzamide
CID 90643074
prop-2-enyl N-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamate
CID 102027973
prop-2-enyl N-[2-(pyridine-3-carbonylamino)ethyl]carbamate
CID 108570449
N-[4-[(4-pyridin-3-yloxyphenyl)sulfamoyl]phenyl]acetamide
CID 1332367
4-pyridin-3-yloxybenzoic acid
CID 22261667
methyl 2-[4-(prop-2-enoxycarbonylamino)phenyl]acetate
CID 167022304
N-[3-[(4-phenoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 55631172
4-oxo-N-(4-phenoxyphenyl)-4-pyridin-3-ylbutanamide
CID 110425632

Frequently Asked Questions

What is the IUPAC name of prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate?
The IUPAC name of prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate (CID 110188366) is prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate.
What is the SMILES notation for prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate?
The canonical SMILES for prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate is C=CCOC(=O)Nc1ccc(Oc2cccnc2)cc1.
What is the InChIKey of prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate?
The InChIKey is RHHQONPWQXIJHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-2-10-19-15(18)17-12-5-7-13(8-6-12)20-14-4-3-9-16-11-14/h2-9,11H,1,10H2,(H,17,18).
What are the key properties of prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate?
prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate has a molecular weight of 270.29 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl N-(4-pyridin-3-yloxyphenyl)carbamate is sourced from PubChem (CID 110188366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).