ethyl-(2-fluorophenyl)carbamic acid

C9H10FNO2 — CID 57376109

IUPACethyl-(2-fluorophenyl)carbamic acid
SMILESCCN(C(=O)O)c1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-2-11(9(12)13)8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,12,13)
InChIKeyBSAYWCZHCBTSCD-UHFFFAOYSA-N
MW183.18 g/mol
LogP2.33
Rot. Bonds2

About ethyl-(2-fluorophenyl)carbamic acid

ethyl-(2-fluorophenyl)carbamic acid (PubChem CID 57376109) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is ethyl-(2-fluorophenyl)carbamic acid.

Molecular Properties

Compound Nameethyl-(2-fluorophenyl)carbamic acid
PubChem CID57376109
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC Nameethyl-(2-fluorophenyl)carbamic acid
SMILESCCN(C(=O)O)c1ccccc1F
InChIInChI=1S/C9H10FNO2/c1-2-11(9(12)13)8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,12,13)
InChIKeyBSAYWCZHCBTSCD-UHFFFAOYSA-N
XLogP2.33
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

benzyl-(2-fluorophenyl)carbamic acid
CID 67213416
(2-fluorophenyl)-(2-phenylethyl)carbamic acid
CID 154111603
5-(N-ethyl-2-fluoroanilino)-3,3-dimethyl-5-oxopentanoic acid
CID 62934429
3-amino-N-ethyl-N-(2-fluorophenyl)pyridine-4-carboxamide
CID 105069177
3-[ethyl-[ethyl-(2-fluorophenyl)carbamoyl]amino]butanoic acid
CID 62827357
3-amino-N-ethyl-N-(2-fluorophenyl)-2-phenylpropanamide
CID 62877338
2-(N-acetyl-2-fluoroanilino)acetic acid
CID 28765395
2-[ethyl-(2-fluorophenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978665
2-[ethyl-(2-fluorophenyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 114390910
3-[ethyl-(2-fluorophenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550638
N-ethyl-N-(2-fluorophenyl)-4-sulfanylthiophene-2-carboxamide
CID 107027791
N-ethyl-N-(2-fluorophenyl)-4-hydroxypentanamide
CID 79192047

Frequently Asked Questions

What is the IUPAC name of ethyl-(2-fluorophenyl)carbamic acid?
The IUPAC name of ethyl-(2-fluorophenyl)carbamic acid (CID 57376109) is ethyl-(2-fluorophenyl)carbamic acid.
What is the SMILES notation for ethyl-(2-fluorophenyl)carbamic acid?
The canonical SMILES for ethyl-(2-fluorophenyl)carbamic acid is CCN(C(=O)O)c1ccccc1F.
What is the InChIKey of ethyl-(2-fluorophenyl)carbamic acid?
The InChIKey is BSAYWCZHCBTSCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c1-2-11(9(12)13)8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,12,13).
What are the key properties of ethyl-(2-fluorophenyl)carbamic acid?
ethyl-(2-fluorophenyl)carbamic acid has a molecular weight of 183.18 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-(2-fluorophenyl)carbamic acid is sourced from PubChem (CID 57376109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).