(2-methoxy-1-phenylethyl)carbamic acid

C10H13NO3 — CID 69063915

IUPAC(2-methoxy-1-phenylethyl)carbamic acid
SMILESCOCC(NC(=O)O)c1ccccc1
InChIInChI=1S/C10H13NO3/c1-14-7-9(11-10(12)13)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,12,13)
InChIKeyRFEOBQUVKTZPPA-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.64
Rot. Bonds4

About (2-methoxy-1-phenylethyl)carbamic acid

(2-methoxy-1-phenylethyl)carbamic acid (PubChem CID 69063915) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is (2-methoxy-1-phenylethyl)carbamic acid.

Molecular Properties

Compound Name(2-methoxy-1-phenylethyl)carbamic acid
PubChem CID69063915
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name(2-methoxy-1-phenylethyl)carbamic acid
SMILESCOCC(NC(=O)O)c1ccccc1
InChIInChI=1S/C10H13NO3/c1-14-7-9(11-10(12)13)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,12,13)
InChIKeyRFEOBQUVKTZPPA-UHFFFAOYSA-N
XLogP1.64
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3-methoxy-1-phenylpropyl)carbamic acid
CID 67224649
N-[(1S)-2-methoxy-1-phenylethyl]prop-1-en-2-amine
CID 89012748
4-hydroxy-N-[(1R)-2-methoxy-1-phenylethyl]-3-methylbenzamide
CID 143001995
1-(4-hydroxy-3-methylbutan-2-yl)-3-(2-methoxy-1-phenylethyl)urea
CID 111455158
N-(2-methoxy-1-phenylethyl)piperidine-4-carboxamide;hydrochloride
CID 119315129
1-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-(2-methoxy-1-phenylethyl)urea
CID 111618774
N-(2-methoxy-1-phenylethyl)piperidine-4-carboxamide
CID 119315130
[(1R)-2-bromo-1-phenylethyl]carbamic acid
CID 146309654
(2-amino-1-phenylethyl)carbamic acid
CID 66600321
1-(3-hydroxy-4-methylpentyl)-3-(2-methoxy-1-phenylethyl)urea
CID 111505801
1-(2-hydroxypentyl)-3-(2-methoxy-1-phenylethyl)urea
CID 111338426
3-[(2-methoxy-1-phenylethyl)amino]-N-propan-2-ylpropanamide
CID 103913617

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-1-phenylethyl)carbamic acid?
The IUPAC name of (2-methoxy-1-phenylethyl)carbamic acid (CID 69063915) is (2-methoxy-1-phenylethyl)carbamic acid.
What is the SMILES notation for (2-methoxy-1-phenylethyl)carbamic acid?
The canonical SMILES for (2-methoxy-1-phenylethyl)carbamic acid is COCC(NC(=O)O)c1ccccc1.
What is the InChIKey of (2-methoxy-1-phenylethyl)carbamic acid?
The InChIKey is RFEOBQUVKTZPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-14-7-9(11-10(12)13)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,12,13).
What are the key properties of (2-methoxy-1-phenylethyl)carbamic acid?
(2-methoxy-1-phenylethyl)carbamic acid has a molecular weight of 195.22 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-1-phenylethyl)carbamic acid is sourced from PubChem (CID 69063915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).