(4,6-dimethyl-2-pyridinyl)carbamic acid

C8H10N2O2 — CID 69070197

IUPAC(4,6-dimethyl-2-pyridinyl)carbamic acid
SMILESCc1cc(C)nc(NC(=O)O)c1
InChIInChI=1S/C8H10N2O2/c1-5-3-6(2)9-7(4-5)10-8(11)12/h3-4H,1-2H3,(H,9,10)(H,11,12)
InChIKeyLCAFNIUAEKLJCT-UHFFFAOYSA-N
MW166.18 g/mol
LogP1.79
Rot. Bonds1

About (4,6-dimethyl-2-pyridinyl)carbamic acid

(4,6-dimethyl-2-pyridinyl)carbamic acid (PubChem CID 69070197) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is (4,6-dimethyl-2-pyridinyl)carbamic acid.

Molecular Properties

Compound Name(4,6-dimethyl-2-pyridinyl)carbamic acid
PubChem CID69070197
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name(4,6-dimethyl-2-pyridinyl)carbamic acid
SMILESCc1cc(C)nc(NC(=O)O)c1
InChIInChI=1S/C8H10N2O2/c1-5-3-6(2)9-7(4-5)10-8(11)12/h3-4H,1-2H3,(H,9,10)(H,11,12)
InChIKeyLCAFNIUAEKLJCT-UHFFFAOYSA-N
XLogP1.79
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4,6-dimethyl-2-pyridinyl)carbamic acid?
The IUPAC name of (4,6-dimethyl-2-pyridinyl)carbamic acid (CID 69070197) is (4,6-dimethyl-2-pyridinyl)carbamic acid.
What is the SMILES notation for (4,6-dimethyl-2-pyridinyl)carbamic acid?
The canonical SMILES for (4,6-dimethyl-2-pyridinyl)carbamic acid is Cc1cc(C)nc(NC(=O)O)c1.
What is the InChIKey of (4,6-dimethyl-2-pyridinyl)carbamic acid?
The InChIKey is LCAFNIUAEKLJCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-5-3-6(2)9-7(4-5)10-8(11)12/h3-4H,1-2H3,(H,9,10)(H,11,12).
What are the key properties of (4,6-dimethyl-2-pyridinyl)carbamic acid?
(4,6-dimethyl-2-pyridinyl)carbamic acid has a molecular weight of 166.18 g/mol, XLogP of 1.79, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4,6-dimethyl-2-pyridinyl)carbamic acid is sourced from PubChem (CID 69070197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).