(6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate

C11H17N3O2 — CID 17325

IUPAC(6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate
SMILESCCCc1nc(C)cc(OC(=O)N(C)C)n1
InChIInChI=1S/C11H17N3O2/c1-5-6-9-12-8(2)7-10(13-9)16-11(15)14(3)4/h7H,5-6H2,1-4H3
InChIKeyCQRUIYKYVFQBRT-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.80
Rot. Bonds3

About (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate

(6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate (PubChem CID 17325) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate
PubChem CID17325
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name(6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate
SMILESCCCc1nc(C)cc(OC(=O)N(C)C)n1
InChIInChI=1S/C11H17N3O2/c1-5-6-9-12-8(2)7-10(13-9)16-11(15)14(3)4/h7H,5-6H2,1-4H3
InChIKeyCQRUIYKYVFQBRT-UHFFFAOYSA-N
XLogP1.80
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate?
The IUPAC name of (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate (CID 17325) is (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate.
What is the SMILES notation for (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate?
The canonical SMILES for (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate is CCCc1nc(C)cc(OC(=O)N(C)C)n1.
What is the InChIKey of (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate?
The InChIKey is CQRUIYKYVFQBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-5-6-9-12-8(2)7-10(13-9)16-11(15)14(3)4/h7H,5-6H2,1-4H3.
What are the key properties of (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate?
(6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate has a molecular weight of 223.28 g/mol, XLogP of 1.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-2-propylpyrimidin-4-yl) N,N-dimethylcarbamate is sourced from PubChem (CID 17325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).