methyl N-(4-methyl-3-pyridinyl)carbamate

C8H10N2O2 — CID 11672725

IUPACmethyl N-(4-methyl-3-pyridinyl)carbamate
SMILESCOC(=O)Nc1cnccc1C
InChIInChI=1S/C8H10N2O2/c1-6-3-4-9-5-7(6)10-8(11)12-2/h3-5H,1-2H3,(H,10,11)
InChIKeyFTEFYIXMXZZAGN-UHFFFAOYSA-N
MW166.18 g/mol
LogP1.57
Rot. Bonds1

About methyl N-(4-methyl-3-pyridinyl)carbamate

methyl N-(4-methyl-3-pyridinyl)carbamate (PubChem CID 11672725) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is methyl N-(4-methyl-3-pyridinyl)carbamate.

Molecular Properties

Compound Namemethyl N-(4-methyl-3-pyridinyl)carbamate
PubChem CID11672725
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Namemethyl N-(4-methyl-3-pyridinyl)carbamate
SMILESCOC(=O)Nc1cnccc1C
InChIInChI=1S/C8H10N2O2/c1-6-3-4-9-5-7(6)10-8(11)12-2/h3-5H,1-2H3,(H,10,11)
InChIKeyFTEFYIXMXZZAGN-UHFFFAOYSA-N
XLogP1.57
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl N-(4-methyl-3-pyridinyl)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

1,3-bis(4-methyl-3-pyridinyl)urea
CID 86818735
N-(4-methyl-3-pyridinyl)prop-2-enamide
CID 63327303
methyl N-(3-iodo-4-pyridinyl)carbamate
CID 130741771
2-methyl-N-(4-methyl-3-pyridinyl)prop-2-enamide
CID 89097906
2-bromo-N-(4-methyl-3-pyridinyl)acetamide
CID 63678424
1-ethyl-3-(4-methyl-3-pyridinyl)urea
CID 115776522
2-(2-aminoethoxy)-N-(4-methyl-3-pyridinyl)acetamide
CID 79478693
2-amino-3-methoxy-N-(4-methyl-3-pyridinyl)propanamide
CID 81089004
2-(ethylamino)-N-(4-methyl-3-pyridinyl)acetamide
CID 63327490
bromomethylbenzene;methyl N-(1-benzyl-4-methylpyridin-1-ium-3-yl)carbamate;methyl N-(4-methyl-3-pyridinyl)carbamate;bromide
CID 161070213
6-chloro-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 63327625
2-hydroxy-N-(4-methyl-3-pyridinyl)benzamide
CID 63327806

Frequently Asked Questions

What is the IUPAC name of methyl N-(4-methyl-3-pyridinyl)carbamate?
The IUPAC name of methyl N-(4-methyl-3-pyridinyl)carbamate (CID 11672725) is methyl N-(4-methyl-3-pyridinyl)carbamate.
What is the SMILES notation for methyl N-(4-methyl-3-pyridinyl)carbamate?
The canonical SMILES for methyl N-(4-methyl-3-pyridinyl)carbamate is COC(=O)Nc1cnccc1C.
What is the InChIKey of methyl N-(4-methyl-3-pyridinyl)carbamate?
The InChIKey is FTEFYIXMXZZAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-6-3-4-9-5-7(6)10-8(11)12-2/h3-5H,1-2H3,(H,10,11).
What are the key properties of methyl N-(4-methyl-3-pyridinyl)carbamate?
methyl N-(4-methyl-3-pyridinyl)carbamate has a molecular weight of 166.18 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(4-methyl-3-pyridinyl)carbamate is sourced from PubChem (CID 11672725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).