(5-phenyl-2-pyridinyl)carbamic acid

C12H10N2O2 — CID 69225879

IUPAC(5-phenyl-2-pyridinyl)carbamic acid
SMILESO=C(O)Nc1ccc(-c2ccccc2)cn1
InChIInChI=1S/C12H10N2O2/c15-12(16)14-11-7-6-10(8-13-11)9-4-2-1-3-5-9/h1-8H,(H,13,14)(H,15,16)
InChIKeyNIQWJNFWRPTDKN-UHFFFAOYSA-N
MW214.22 g/mol
LogP2.84
Rot. Bonds2

About (5-phenyl-2-pyridinyl)carbamic acid

(5-phenyl-2-pyridinyl)carbamic acid (PubChem CID 69225879) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is (5-phenyl-2-pyridinyl)carbamic acid.

Molecular Properties

Compound Name(5-phenyl-2-pyridinyl)carbamic acid
PubChem CID69225879
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name(5-phenyl-2-pyridinyl)carbamic acid
SMILESO=C(O)Nc1ccc(-c2ccccc2)cn1
InChIInChI=1S/C12H10N2O2/c15-12(16)14-11-7-6-10(8-13-11)9-4-2-1-3-5-9/h1-8H,(H,13,14)(H,15,16)
InChIKeyNIQWJNFWRPTDKN-UHFFFAOYSA-N
XLogP2.84
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-phenyl-2-pyridinyl)carbamic acid?
The IUPAC name of (5-phenyl-2-pyridinyl)carbamic acid (CID 69225879) is (5-phenyl-2-pyridinyl)carbamic acid.
What is the SMILES notation for (5-phenyl-2-pyridinyl)carbamic acid?
The canonical SMILES for (5-phenyl-2-pyridinyl)carbamic acid is O=C(O)Nc1ccc(-c2ccccc2)cn1.
What is the InChIKey of (5-phenyl-2-pyridinyl)carbamic acid?
The InChIKey is NIQWJNFWRPTDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c15-12(16)14-11-7-6-10(8-13-11)9-4-2-1-3-5-9/h1-8H,(H,13,14)(H,15,16).
What are the key properties of (5-phenyl-2-pyridinyl)carbamic acid?
(5-phenyl-2-pyridinyl)carbamic acid has a molecular weight of 214.22 g/mol, XLogP of 2.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-phenyl-2-pyridinyl)carbamic acid is sourced from PubChem (CID 69225879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).