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

C6H12N4 — CID 151518064

IUPAC6-N,4-dimethyl-1H-pyrimidine-4,6-diamine
SMILESCNC1=CC(C)(N)N=CN1
InChIInChI=1S/C6H12N4/c1-6(7)3-5(8-2)9-4-10-6/h3-4,8H,7H2,1-2H3,(H,9,10)
InChIKeyPTWKXMJYIKVNHK-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.65
Rot. Bonds1

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

6-N,4-dimethyl-1H-pyrimidine-4,6-diamine (PubChem CID 151518064) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N,4-dimethyl-1H-pyrimidine-4,6-diamine
PubChem CID151518064
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC Name6-N,4-dimethyl-1H-pyrimidine-4,6-diamine
SMILESCNC1=CC(C)(N)N=CN1
InChIInChI=1S/C6H12N4/c1-6(7)3-5(8-2)9-4-10-6/h3-4,8H,7H2,1-2H3,(H,9,10)
InChIKeyPTWKXMJYIKVNHK-UHFFFAOYSA-N
XLogP-0.65
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-Methyl(4-amino)pyrimidine
CID 129876017
4-ethyl-1H-pyrimidine-2,4-diamine
CID 67413305
4-methyl-1H-pyrimidine-2,4-diamine
CID 68412964
N-ethyl-1,4-dihydropyrimidin-6-amine
CID 118973305
N,4-dimethyl-1H-pyrimidin-4-amine
CID 123208340
N,4-dimethyl-1,4-dihydropyrimidin-6-amine
CID 129239360
4-N,4-dimethyl-1H-pyrimidine-4,6-diamine
CID 142666880
N-methyl-1,4-dihydropyrimidin-6-amine
CID 146638483
4-N,4-dimethyl-1H-pyrimidine-2,4-diamine
CID 152780332
4-prop-2-ynyl-1H-pyrimidine-4,6-diamine
CID 154136672
4-propyl-1H-pyrimidine-4,6-diamine
CID 154166879
4-methyl-1H-pyrimidine-4,6-diamine
CID 154280155

Frequently Asked Questions

What is the IUPAC name of 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine?
The IUPAC name of 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine (CID 151518064) is 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine.
What is the SMILES notation for 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine?
The canonical SMILES for 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine is CNC1=CC(C)(N)N=CN1.
What is the InChIKey of 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine?
The InChIKey is PTWKXMJYIKVNHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4/c1-6(7)3-5(8-2)9-4-10-6/h3-4,8H,7H2,1-2H3,(H,9,10).
What are the key properties of 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine?
6-N,4-dimethyl-1H-pyrimidine-4,6-diamine has a molecular weight of 140.19 g/mol, XLogP of -0.65, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,4-dimethyl-1H-pyrimidine-4,6-diamine is sourced from PubChem (CID 151518064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).