(1-phenyl-2-pyridin-2-ylethyl)carbamic acid

C14H14N2O2 — CID 134541861

IUPAC(1-phenyl-2-pyridin-2-ylethyl)carbamic acid
SMILESO=C(O)NC(Cc1ccccn1)c1ccccc1
InChIInChI=1S/C14H14N2O2/c17-14(18)16-13(11-6-2-1-3-7-11)10-12-8-4-5-9-15-12/h1-9,13,16H,10H2,(H,17,18)
InChIKeyARENMXSZCZTOSK-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.63
Rot. Bonds4

About (1-phenyl-2-pyridin-2-ylethyl)carbamic acid

(1-phenyl-2-pyridin-2-ylethyl)carbamic acid (PubChem CID 134541861) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is (1-phenyl-2-pyridin-2-ylethyl)carbamic acid.

Molecular Properties

Compound Name(1-phenyl-2-pyridin-2-ylethyl)carbamic acid
PubChem CID134541861
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name(1-phenyl-2-pyridin-2-ylethyl)carbamic acid
SMILESO=C(O)NC(Cc1ccccn1)c1ccccc1
InChIInChI=1S/C14H14N2O2/c17-14(18)16-13(11-6-2-1-3-7-11)10-12-8-4-5-9-15-12/h1-9,13,16H,10H2,(H,17,18)
InChIKeyARENMXSZCZTOSK-UHFFFAOYSA-N
XLogP2.63
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]propanamide
CID 134542197
(2S)-2-(carboxyamino)-3-pyridin-2-ylpropanoic acid
CID 90150229
1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[(1S)-1-phenyl-2-pyridin-2-ylethyl]urea
CID 129358685
1,3,5-trimethyl-N-[(1R)-1-phenyl-2-pyridin-2-ylethyl]pyrazole-4-carboxamide
CID 124872713
N-(1-phenyl-2-pyridin-2-ylethyl)formamide
CID 57000523
[(1S)-1-(4-bromophenyl)-2-pyridin-2-ylethyl]urea
CID 99792892
1-amino-N-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]cyclopropane-1-carboxamide
CID 134541309
(2S)-2-(methylamino)-N-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]propanamide
CID 134541575
(1S)-N-ethyl-1-phenyl-2-pyridin-2-ylethanamine
CID 129365604
N,N'-bis[(1R)-1-phenyl-2-pyridin-2-ylethyl]propane-1,3-diamine
CID 102584855
2-[[(2S)-2-aminopropanoyl]amino]-2-methyl-N-[(1S)-1-phenyl-2-pyridin-2-ylethyl]propanamide
CID 134542231
N-[2-[methyl-[2-oxo-2-[(1-phenyl-2-pyridin-2-ylethyl)amino]ethyl]amino]-2-oxoethyl]propanamide
CID 134543822

Frequently Asked Questions

What is the IUPAC name of (1-phenyl-2-pyridin-2-ylethyl)carbamic acid?
The IUPAC name of (1-phenyl-2-pyridin-2-ylethyl)carbamic acid (CID 134541861) is (1-phenyl-2-pyridin-2-ylethyl)carbamic acid.
What is the SMILES notation for (1-phenyl-2-pyridin-2-ylethyl)carbamic acid?
The canonical SMILES for (1-phenyl-2-pyridin-2-ylethyl)carbamic acid is O=C(O)NC(Cc1ccccn1)c1ccccc1.
What is the InChIKey of (1-phenyl-2-pyridin-2-ylethyl)carbamic acid?
The InChIKey is ARENMXSZCZTOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-14(18)16-13(11-6-2-1-3-7-11)10-12-8-4-5-9-15-12/h1-9,13,16H,10H2,(H,17,18).
What are the key properties of (1-phenyl-2-pyridin-2-ylethyl)carbamic acid?
(1-phenyl-2-pyridin-2-ylethyl)carbamic acid has a molecular weight of 242.28 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-phenyl-2-pyridin-2-ylethyl)carbamic acid is sourced from PubChem (CID 134541861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).