6-methyl-1,4-dihydropyrimidine-4,5-diamine

C5H10N4 — CID 154521869

IUPAC6-methyl-1,4-dihydropyrimidine-4,5-diamine
SMILESCC1=C(N)C(N)N=CN1
InChIInChI=1S/C5H10N4/c1-3-4(6)5(7)9-2-8-3/h2,5H,6-7H2,1H3,(H,8,9)
InChIKeyJBVBGSBTPHEYSA-UHFFFAOYSA-N
MW126.16 g/mol
LogP-0.91
Rot. Bonds

About 6-methyl-1,4-dihydropyrimidine-4,5-diamine

6-methyl-1,4-dihydropyrimidine-4,5-diamine (PubChem CID 154521869) has the molecular formula C5H10N4 and a molecular weight of 126.16 g/mol. Its IUPAC name is 6-methyl-1,4-dihydropyrimidine-4,5-diamine.

Molecular Properties

Compound Name6-methyl-1,4-dihydropyrimidine-4,5-diamine
PubChem CID154521869
Molecular FormulaC5H10N4
Molecular Weight126.16 g/mol
Exact Mass126.09
IUPAC Name6-methyl-1,4-dihydropyrimidine-4,5-diamine
SMILESCC1=C(N)C(N)N=CN1
InChIInChI=1S/C5H10N4/c1-3-4(6)5(7)9-2-8-3/h2,5H,6-7H2,1H3,(H,8,9)
InChIKeyJBVBGSBTPHEYSA-UHFFFAOYSA-N
XLogP-0.91
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 6-methyl-1,4-dihydropyrimidine-4,5-diamine 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

6-Methyl-1,4-dihydropyrimidine
CID 19748724
5,6-Dimethyl-1,4-dihydropyrimidine
CID 58863324
N,6-dimethyl-1,4-dihydropyrimidin-5-amine
CID 89418734
5,6-Dimethyl-1,4-dihydropyrimidin-4-amine
CID 90453936
6-Methyl-1,4-dihydropyrimidin-4-amine
CID 90454007
5,6-Dimethyl-1,4-dihydropyrimidine;ethane
CID 91034579
N-methyl-6-(methylideneamino)-1,4-dihydropyrimidin-5-amine
CID 123175950
4,7-dihydro-1H-purine-2,6-diamine
CID 131970278
5-N-butyl-6-methyl-1,4-dihydropyrimidine-4,5-diamine
CID 135172663
6-Methyl-1,4-dihydropyrimidin-5-amine
CID 142030297
5-amino-6-methyl-1H-pyrimidine-4-thione;methane
CID 143110415
5-amino-6-methyl-1H-pyrimidine-4-thione;ethane
CID 144396145

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,4-dihydropyrimidine-4,5-diamine?
The IUPAC name of 6-methyl-1,4-dihydropyrimidine-4,5-diamine (CID 154521869) is 6-methyl-1,4-dihydropyrimidine-4,5-diamine.
What is the SMILES notation for 6-methyl-1,4-dihydropyrimidine-4,5-diamine?
The canonical SMILES for 6-methyl-1,4-dihydropyrimidine-4,5-diamine is CC1=C(N)C(N)N=CN1.
What is the InChIKey of 6-methyl-1,4-dihydropyrimidine-4,5-diamine?
The InChIKey is JBVBGSBTPHEYSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4/c1-3-4(6)5(7)9-2-8-3/h2,5H,6-7H2,1H3,(H,8,9).
What are the key properties of 6-methyl-1,4-dihydropyrimidine-4,5-diamine?
6-methyl-1,4-dihydropyrimidine-4,5-diamine has a molecular weight of 126.16 g/mol, XLogP of -0.91, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1,4-dihydropyrimidine-4,5-diamine is sourced from PubChem (CID 154521869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).