4,6-dimethyl-1H-pyrimidine-2,4-diamine

C6H12N4 — CID 154451700

IUPAC4,6-dimethyl-1H-pyrimidine-2,4-diamine
SMILESCC1=CC(C)(N)N=C(N)N1
InChIInChI=1S/C6H12N4/c1-4-3-6(2,8)10-5(7)9-4/h3H,8H2,1-2H3,(H3,7,9,10)
InChIKeyHDVOOLPZRAMTPT-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.52
Rot. Bonds

About 4,6-dimethyl-1H-pyrimidine-2,4-diamine

4,6-dimethyl-1H-pyrimidine-2,4-diamine (PubChem CID 154451700) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is 4,6-dimethyl-1H-pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4,6-dimethyl-1H-pyrimidine-2,4-diamine
PubChem CID154451700
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC Name4,6-dimethyl-1H-pyrimidine-2,4-diamine
SMILESCC1=CC(C)(N)N=C(N)N1
InChIInChI=1S/C6H12N4/c1-4-3-6(2,8)10-5(7)9-4/h3H,8H2,1-2H3,(H3,7,9,10)
InChIKeyHDVOOLPZRAMTPT-UHFFFAOYSA-N
XLogP-0.52
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(4,4,6-Trimethyl-1,4-dihydropyrimidin-2-yl)cyanamide
CID 667216
4,4,6-trimethyl-1H-pyrimidin-2-amine
CID 287218
6-Ethyl-1,4-dihydropyrimidine-2,4-diamine
CID 126732468
1-[(E)-hex-3-en-3-yl]-2-methylguanidine
CID 132238786
1-Cyclohexa-1,5-dien-1-yl-2-methylguanidine
CID 143088471
4,6-dimethyl-1H-pyrimidin-4-ide;lawrencium
CID 145531779
1-Cyclohepta-1,3,6-trien-1-yl-3-(diaminomethylidene)-2-methylguanidine
CID 145606983
2,4,6-trimethyl-1H-pyrimidin-4-amine
CID 146415546
4-butyl-6-methyl-1H-pyrimidine-2,4-diamine
CID 150929560
N,4,6-trimethyl-3,4-dihydro-1H-pyrimidin-2-imine
CID 163525402
4-ethyl-6-methyl-1H-pyrimidine-2,4-diamine
CID 175809532
(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)cyanamide
CID 7167508

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-1H-pyrimidine-2,4-diamine?
The IUPAC name of 4,6-dimethyl-1H-pyrimidine-2,4-diamine (CID 154451700) is 4,6-dimethyl-1H-pyrimidine-2,4-diamine.
What is the SMILES notation for 4,6-dimethyl-1H-pyrimidine-2,4-diamine?
The canonical SMILES for 4,6-dimethyl-1H-pyrimidine-2,4-diamine is CC1=CC(C)(N)N=C(N)N1.
What is the InChIKey of 4,6-dimethyl-1H-pyrimidine-2,4-diamine?
The InChIKey is HDVOOLPZRAMTPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4/c1-4-3-6(2,8)10-5(7)9-4/h3H,8H2,1-2H3,(H3,7,9,10).
What are the key properties of 4,6-dimethyl-1H-pyrimidine-2,4-diamine?
4,6-dimethyl-1H-pyrimidine-2,4-diamine has a molecular weight of 140.19 g/mol, XLogP of -0.52, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-1H-pyrimidine-2,4-diamine is sourced from PubChem (CID 154451700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).