N,4-dimethyl-1H-pyrimidin-4-amine

C6H11N3 — CID 123208340

IUPACN,4-dimethyl-1H-pyrimidin-4-amine
SMILESCNC1(C)C=CNC=N1
InChIInChI=1S/C6H11N3/c1-6(7-2)3-4-8-5-9-6/h3-5,7H,1-2H3,(H,8,9)
InChIKeyVDHYJGWGZWITIQ-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.07
Rot. Bonds1

About N,4-dimethyl-1H-pyrimidin-4-amine

N,4-dimethyl-1H-pyrimidin-4-amine (PubChem CID 123208340) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is N,4-dimethyl-1H-pyrimidin-4-amine.

Molecular Properties

Compound NameN,4-dimethyl-1H-pyrimidin-4-amine
PubChem CID123208340
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC NameN,4-dimethyl-1H-pyrimidin-4-amine
SMILESCNC1(C)C=CNC=N1
InChIInChI=1S/C6H11N3/c1-6(7-2)3-4-8-5-9-6/h3-5,7H,1-2H3,(H,8,9)
InChIKeyVDHYJGWGZWITIQ-UHFFFAOYSA-N
XLogP0.07
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N,4-dimethyl-1H-pyrimidin-4-amine 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

4-Methyl-4-methylpyrimidine
CID 57075565
4-Methyl(4-amino)pyrimidine
CID 129876017
4-Methyl-1,4-dihydropyrimidine
CID 55286629
4-propan-2-yl-1H-pyrimidine-2,4-diamine
CID 67413100
4-ethyl-1H-pyrimidine-2,4-diamine
CID 67413305
2-chloro-4,4-dimethyl-1H-pyrimidine
CID 67479805
4-methyl-1H-pyrimidine-4,5-diamine
CID 67872043
4-methyl-1H-pyrimidine-2,4-diamine
CID 68412964
N-[(E)-but-1-enyl]-N'-methylmethanimidamide
CID 89294540
2,4-Dimethyl-1,4-dihydropyrimidine
CID 89750388
N-methyl-1,4-dihydropyrimidin-4-amine
CID 90451864
N'-methyl-N-[(Z)-3-(methylamino)prop-1-enyl]methanimidamide
CID 90452805

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1H-pyrimidin-4-amine?
The IUPAC name of N,4-dimethyl-1H-pyrimidin-4-amine (CID 123208340) is N,4-dimethyl-1H-pyrimidin-4-amine.
What is the SMILES notation for N,4-dimethyl-1H-pyrimidin-4-amine?
The canonical SMILES for N,4-dimethyl-1H-pyrimidin-4-amine is CNC1(C)C=CNC=N1.
What is the InChIKey of N,4-dimethyl-1H-pyrimidin-4-amine?
The InChIKey is VDHYJGWGZWITIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-6(7-2)3-4-8-5-9-6/h3-5,7H,1-2H3,(H,8,9).
What are the key properties of N,4-dimethyl-1H-pyrimidin-4-amine?
N,4-dimethyl-1H-pyrimidin-4-amine has a molecular weight of 125.17 g/mol, XLogP of 0.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1H-pyrimidin-4-amine is sourced from PubChem (CID 123208340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).