(4-phenylmethoxy-2-pyridinyl) carbamate

C13H12N2O3 — CID 175517268

IUPAC(4-phenylmethoxy-2-pyridinyl) carbamate
SMILESNC(=O)Oc1cc(OCc2ccccc2)ccn1
InChIInChI=1S/C13H12N2O3/c14-13(16)18-12-8-11(6-7-15-12)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,14,16)
InChIKeyQIFRXCCOTHYDPO-UHFFFAOYSA-N
MW244.25 g/mol
LogP2.12
Rot. Bonds4

About (4-phenylmethoxy-2-pyridinyl) carbamate

(4-phenylmethoxy-2-pyridinyl) carbamate (PubChem CID 175517268) has the molecular formula C13H12N2O3 and a molecular weight of 244.25 g/mol. Its IUPAC name is (4-phenylmethoxy-2-pyridinyl) carbamate.

Molecular Properties

Compound Name(4-phenylmethoxy-2-pyridinyl) carbamate
PubChem CID175517268
Molecular FormulaC13H12N2O3
Molecular Weight244.25 g/mol
Exact Mass244.08
IUPAC Name(4-phenylmethoxy-2-pyridinyl) carbamate
SMILESNC(=O)Oc1cc(OCc2ccccc2)ccn1
InChIInChI=1S/C13H12N2O3/c14-13(16)18-12-8-11(6-7-15-12)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,14,16)
InChIKeyQIFRXCCOTHYDPO-UHFFFAOYSA-N
XLogP2.12
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(difluoromethoxy)-4-phenylmethoxypyridine
CID 18994132
1-(4-phenylmethoxy-2-pyridinyl)ethanone
CID 151357228
2-[(4-methylphenyl)methoxy]-4-phenylmethoxypyridine
CID 67304946
(E)-3-amino-2-(4-phenylmethoxy-2-pyridinyl)but-2-enoic acid
CID 170603679
2-oxo-3-(4-phenylmethoxy-2-pyridinyl)propanoic acid
CID 91387791
2-(4-phenylmethoxyphenoxy)ethyl carbamate
CID 175203951
4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine
CID 102467208
2-ethyl-4-phenylmethoxypyridine
CID 130153338
3-hydroxy-3-(3-phenylmethoxyphenyl)propanamide
CID 68644594
N-methoxy-2-phenylmethoxypyridine-4-carboxamide
CID 47366546
2-carboxy-5-phenylmethoxyphenolate
CID 86309199
(3-phenylmethoxyphenyl) (2S)-2-aminopropanoate
CID 67767154

Frequently Asked Questions

What is the IUPAC name of (4-phenylmethoxy-2-pyridinyl) carbamate?
The IUPAC name of (4-phenylmethoxy-2-pyridinyl) carbamate (CID 175517268) is (4-phenylmethoxy-2-pyridinyl) carbamate.
What is the SMILES notation for (4-phenylmethoxy-2-pyridinyl) carbamate?
The canonical SMILES for (4-phenylmethoxy-2-pyridinyl) carbamate is NC(=O)Oc1cc(OCc2ccccc2)ccn1.
What is the InChIKey of (4-phenylmethoxy-2-pyridinyl) carbamate?
The InChIKey is QIFRXCCOTHYDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O3/c14-13(16)18-12-8-11(6-7-15-12)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,14,16).
What are the key properties of (4-phenylmethoxy-2-pyridinyl) carbamate?
(4-phenylmethoxy-2-pyridinyl) carbamate has a molecular weight of 244.25 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenylmethoxy-2-pyridinyl) carbamate is sourced from PubChem (CID 175517268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).