2,4,6-trimethyl-1H-pyrimidin-4-amine

C7H13N3 — CID 146415546

IUPAC2,4,6-trimethyl-1H-pyrimidin-4-amine
SMILESCC1=CC(C)(N)N=C(C)N1
InChIInChI=1S/C7H13N3/c1-5-4-7(3,8)10-6(2)9-5/h4H,8H2,1-3H3,(H,9,10)
InChIKeyIQUIGDQHNPMPQW-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.59
Rot. Bonds

About 2,4,6-trimethyl-1H-pyrimidin-4-amine

2,4,6-trimethyl-1H-pyrimidin-4-amine (PubChem CID 146415546) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 2,4,6-trimethyl-1H-pyrimidin-4-amine.

Molecular Properties

Compound Name2,4,6-trimethyl-1H-pyrimidin-4-amine
PubChem CID146415546
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name2,4,6-trimethyl-1H-pyrimidin-4-amine
SMILESCC1=CC(C)(N)N=C(C)N1
InChIInChI=1S/C7H13N3/c1-5-4-7(3,8)10-6(2)9-5/h4H,8H2,1-3H3,(H,9,10)
InChIKeyIQUIGDQHNPMPQW-UHFFFAOYSA-N
XLogP0.59
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

InChI=1/C8H14N2/c1-6-5-8(3,4)10-7(2)9-6/h5H,1-4H3,(H,9,10
CID 13526003
2,6-Dimethyl-1,4-dihydropyrimidine
CID 57135030
2,4,6-Trimethyl-1,4-dihydropyrimidine
CID 68611629
2,4-dimethyl-6-methylidene-1H-pyrimidine
CID 89182777
N'-pent-2-en-2-ylethanimidamide
CID 123240673
6-Buta-1,3-dienyl-2,4-dimethyl-1,4-dihydropyrimidine
CID 123490451
N'-[(E)-pent-2-en-2-yl]ethanimidamide
CID 123500479
2,6-Dimethyl-1,4-dihydropyrimidin-4-amine
CID 129196301
N,5-dimethyl-1,3-dihydropyrrol-2-imine
CID 136037612
N,6-dimethyl-3,4-dihydro-1H-pyridin-2-imine
CID 137043003
N'-ethyl-N-[(E)-hex-3-en-3-yl]ethanimidamide
CID 139497311
N'-methyl-N-[(Z)-4-methyliminopent-2-en-2-yl]ethanimidamide
CID 147463171

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-1H-pyrimidin-4-amine?
The IUPAC name of 2,4,6-trimethyl-1H-pyrimidin-4-amine (CID 146415546) is 2,4,6-trimethyl-1H-pyrimidin-4-amine.
What is the SMILES notation for 2,4,6-trimethyl-1H-pyrimidin-4-amine?
The canonical SMILES for 2,4,6-trimethyl-1H-pyrimidin-4-amine is CC1=CC(C)(N)N=C(C)N1.
What is the InChIKey of 2,4,6-trimethyl-1H-pyrimidin-4-amine?
The InChIKey is IQUIGDQHNPMPQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-5-4-7(3,8)10-6(2)9-5/h4H,8H2,1-3H3,(H,9,10).
What are the key properties of 2,4,6-trimethyl-1H-pyrimidin-4-amine?
2,4,6-trimethyl-1H-pyrimidin-4-amine has a molecular weight of 139.20 g/mol, XLogP of 0.59, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-1H-pyrimidin-4-amine is sourced from PubChem (CID 146415546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).