[4-(pyridin-2-ylmethyl)phenyl] carbamate

C13H12N2O2 — CID 174850668

IUPAC[4-(pyridin-2-ylmethyl)phenyl] carbamate
SMILESNC(=O)Oc1ccc(Cc2ccccn2)cc1
InChIInChI=1S/C13H12N2O2/c14-13(16)17-12-6-4-10(5-7-12)9-11-3-1-2-8-15-11/h1-8H,9H2,(H2,14,16)
InChIKeyFSKBJDMUSVNXJQ-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.13
Rot. Bonds3

About [4-(pyridin-2-ylmethyl)phenyl] carbamate

[4-(pyridin-2-ylmethyl)phenyl] carbamate (PubChem CID 174850668) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is [4-(pyridin-2-ylmethyl)phenyl] carbamate.

Molecular Properties

Compound Name[4-(pyridin-2-ylmethyl)phenyl] carbamate
PubChem CID174850668
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC Name[4-(pyridin-2-ylmethyl)phenyl] carbamate
SMILESNC(=O)Oc1ccc(Cc2ccccn2)cc1
InChIInChI=1S/C13H12N2O2/c14-13(16)17-12-6-4-10(5-7-12)9-11-3-1-2-8-15-11/h1-8H,9H2,(H2,14,16)
InChIKeyFSKBJDMUSVNXJQ-UHFFFAOYSA-N
XLogP2.13
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(pyridin-2-ylmethyl)phenyl] carbamate 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

3-[4-(pyridin-2-ylmethyl)phenyl]propanoic acid
CID 19840714
2-benzylpyridine;(Z)-but-2-enedioic acid
CID 5356234
2-[[3,5-bis(pyridin-2-ylmethyl)phenyl]methyl]pyridine
CID 102075718
2-[6-[4-[4-(pyridin-2-ylmethyl)phenoxy]carbonylpiperazin-1-yl]-3-pyridinyl]acetic acid
CID 11362484
(4-ethylphenyl) carbamate
CID 1269945
(4-chlorophenyl)methyl N-[4-(pyridin-2-ylmethyl)phenyl]carbamate
CID 171824793
2-[4-(pyridin-2-ylmethoxy)phenyl]acetic acid
CID 18958983
2-(4-carbamoyloxyphenyl)acetic acid
CID 54293995
(E)-2-methyl-3-[4-(pyridin-2-ylmethyl)phenyl]prop-2-enoic acid;hydrochloride
CID 66781094
[4-[(2R)-2-aminopropyl]phenyl] carbamate
CID 66608683
molecular hydrogen;2-pyridin-2-ylacetamide
CID 145224814
4-(dimethylamino)-4-[4-(pyridin-2-ylmethyl)phenyl]butan-2-one
CID 59078586

Frequently Asked Questions

What is the IUPAC name of [4-(pyridin-2-ylmethyl)phenyl] carbamate?
The IUPAC name of [4-(pyridin-2-ylmethyl)phenyl] carbamate (CID 174850668) is [4-(pyridin-2-ylmethyl)phenyl] carbamate.
What is the SMILES notation for [4-(pyridin-2-ylmethyl)phenyl] carbamate?
The canonical SMILES for [4-(pyridin-2-ylmethyl)phenyl] carbamate is NC(=O)Oc1ccc(Cc2ccccn2)cc1.
What is the InChIKey of [4-(pyridin-2-ylmethyl)phenyl] carbamate?
The InChIKey is FSKBJDMUSVNXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c14-13(16)17-12-6-4-10(5-7-12)9-11-3-1-2-8-15-11/h1-8H,9H2,(H2,14,16).
What are the key properties of [4-(pyridin-2-ylmethyl)phenyl] carbamate?
[4-(pyridin-2-ylmethyl)phenyl] carbamate has a molecular weight of 228.25 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(pyridin-2-ylmethyl)phenyl] carbamate is sourced from PubChem (CID 174850668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).