(4-ethenylphenyl)carbamic acid

C9H9NO2 — CID 22352089

IUPAC(4-ethenylphenyl)carbamic acid
SMILESC=Cc1ccc(NC(=O)O)cc1
InChIInChI=1S/C9H9NO2/c1-2-7-3-5-8(6-4-7)10-9(11)12/h2-6,10H,1H2,(H,11,12)
InChIKeyMDUKNJJBZMHYRT-UHFFFAOYSA-N
MW163.18 g/mol
LogP2.42
Rot. Bonds2

About (4-ethenylphenyl)carbamic acid

(4-ethenylphenyl)carbamic acid (PubChem CID 22352089) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is (4-ethenylphenyl)carbamic acid.

Molecular Properties

Compound Name(4-ethenylphenyl)carbamic acid
PubChem CID22352089
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name(4-ethenylphenyl)carbamic acid
SMILESC=Cc1ccc(NC(=O)O)cc1
InChIInChI=1S/C9H9NO2/c1-2-7-3-5-8(6-4-7)10-9(11)12/h2-6,10H,1H2,(H,11,12)
InChIKeyMDUKNJJBZMHYRT-UHFFFAOYSA-N
XLogP2.42
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze (4-ethenylphenyl)carbamic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N'-bis(4-ethenylphenyl)butanediamide
CID 12519604
N-(4-ethenylphenyl)-2,2-diphenylacetamide
CID 122527147
2-amino-N-[2-(4-ethenylanilino)-2-oxoethyl]acetamide
CID 143732888
N-(4-aminophenyl)-4-ethenylbenzamide
CID 13082944
2-methyl-N-phenylprop-2-enamide;styrene
CID 70398128
2-N,6-N-bis(4-ethenylphenyl)pyridine-2,6-dicarboxamide
CID 156600187
1-(4-ethenylphenyl)-3-[6-[(4-ethenylphenyl)carbamoylamino]hexyl]urea
CID 11704173
N-(4-ethenylphenyl)hexanamide
CID 132540479
ethenoxyethene;phenylcarbamic acid
CID 159140981
1,4-bis(ethenyl)benzene;urea
CID 18766675
4-(aminomethyl)-N-(4-ethenylphenyl)benzamide
CID 166434633
2-(2,2-dihydroxyethoxy)-N-(4-ethenylphenyl)acetamide
CID 163784591

Frequently Asked Questions

What is the IUPAC name of (4-ethenylphenyl)carbamic acid?
The IUPAC name of (4-ethenylphenyl)carbamic acid (CID 22352089) is (4-ethenylphenyl)carbamic acid.
What is the SMILES notation for (4-ethenylphenyl)carbamic acid?
The canonical SMILES for (4-ethenylphenyl)carbamic acid is C=Cc1ccc(NC(=O)O)cc1.
What is the InChIKey of (4-ethenylphenyl)carbamic acid?
The InChIKey is MDUKNJJBZMHYRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c1-2-7-3-5-8(6-4-7)10-9(11)12/h2-6,10H,1H2,(H,11,12).
What are the key properties of (4-ethenylphenyl)carbamic acid?
(4-ethenylphenyl)carbamic acid has a molecular weight of 163.18 g/mol, XLogP of 2.42, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenylphenyl)carbamic acid is sourced from PubChem (CID 22352089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).