N-methoxy-N,6-dimethylpyrimidine-4-carboxamide

C8H11N3O2 — CID 121395327

IUPACN-methoxy-N,6-dimethylpyrimidine-4-carboxamide
SMILESCON(C)C(=O)c1cc(C)ncn1
InChIInChI=1S/C8H11N3O2/c1-6-4-7(10-5-9-6)8(12)11(2)13-3/h4-5H,1-3H3
InChIKeyRYLMGWHGFCMPRZ-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.42
Rot. Bonds2

About N-methoxy-N,6-dimethylpyrimidine-4-carboxamide

N-methoxy-N,6-dimethylpyrimidine-4-carboxamide (PubChem CID 121395327) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-methoxy-N,6-dimethylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-methoxy-N,6-dimethylpyrimidine-4-carboxamide
PubChem CID121395327
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN-methoxy-N,6-dimethylpyrimidine-4-carboxamide
SMILESCON(C)C(=O)c1cc(C)ncn1
InChIInChI=1S/C8H11N3O2/c1-6-4-7(10-5-9-6)8(12)11(2)13-3/h4-5H,1-3H3
InChIKeyRYLMGWHGFCMPRZ-UHFFFAOYSA-N
XLogP0.42
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methoxy-N,6-dimethylpyrimidine-4-carboxamide 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

N-methoxy-N-methylpyrimidine-4-carboxamide
CID 53404830
N-methoxy-N,5-dimethyl-1,2-oxazole-3-carboxamide
CID 45099367
N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide
CID 158794501
4-methyl-2-[methyl-(6-methylpyrimidine-4-carbonyl)amino]pentanoic acid
CID 110836313
2-bromo-1-(6-methylpyrimidin-4-yl)ethanone
CID 160890814
6-methyl-N-propylpyrimidine-4-carboxamide
CID 110847771
N-methoxy-N,5,6-trimethylpyridine-3-carboxamide
CID 130211578
5-chloro-N-methoxy-N-methylpyridine-2-carboxamide
CID 59108636
N,3,5-trimethoxy-N,4-dimethylbenzamide
CID 23137896
2-(3-chloro-5-methyl-2-pyridinyl)-N-methoxy-N-methyltriazole-4-carboxamide
CID 165087809
3-(6-methylpyrimidin-4-yl)-3-oxopropanal
CID 55266139
CID 59369486
CID 59369486

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N,6-dimethylpyrimidine-4-carboxamide?
The IUPAC name of N-methoxy-N,6-dimethylpyrimidine-4-carboxamide (CID 121395327) is N-methoxy-N,6-dimethylpyrimidine-4-carboxamide.
What is the SMILES notation for N-methoxy-N,6-dimethylpyrimidine-4-carboxamide?
The canonical SMILES for N-methoxy-N,6-dimethylpyrimidine-4-carboxamide is CON(C)C(=O)c1cc(C)ncn1.
What is the InChIKey of N-methoxy-N,6-dimethylpyrimidine-4-carboxamide?
The InChIKey is RYLMGWHGFCMPRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-6-4-7(10-5-9-6)8(12)11(2)13-3/h4-5H,1-3H3.
What are the key properties of N-methoxy-N,6-dimethylpyrimidine-4-carboxamide?
N-methoxy-N,6-dimethylpyrimidine-4-carboxamide has a molecular weight of 181.19 g/mol, XLogP of 0.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,6-dimethylpyrimidine-4-carboxamide is sourced from PubChem (CID 121395327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).