6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine

C15H28N4 — CID 107871767

IUPAC6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine
SMILESCNc1cc(N(CCC(C)C)CCC(C)C)ncn1
InChIInChI=1S/C15H28N4/c1-12(2)6-8-19(9-7-13(3)4)15-10-14(16-5)17-11-18-15/h10-13H,6-9H2,1-5H3,(H,16,17,18)
InChIKeyGTPSNVWJLFXRMZ-UHFFFAOYSA-N
MW264.42 g/mol
LogP3.42
Rot. Bonds8

About 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine

6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine (PubChem CID 107871767) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine
PubChem CID107871767
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine
SMILESCNc1cc(N(CCC(C)C)CCC(C)C)ncn1
InChIInChI=1S/C15H28N4/c1-12(2)6-8-19(9-7-13(3)4)15-10-14(16-5)17-11-18-15/h10-13H,6-9H2,1-5H3,(H,16,17,18)
InChIKeyGTPSNVWJLFXRMZ-UHFFFAOYSA-N
XLogP3.42
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-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

4-N,4-N-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80767008
2-[ethyl-[6-(methylamino)pyrimidin-4-yl]amino]-N-methylacetamide
CID 80809279
5-(methylaminomethyl)-N,N-bis(3-methylbutyl)pyrazin-2-amine
CID 107871217
6-hydrazinyl-N,N-dipropylpyrimidin-4-amine
CID 80932802
4-N-cyclopropyl-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 80775441
6-hydrazinyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-2,4-diamine
CID 107871833
6-N-(3-amino-2-methylpropyl)-4-N-methyl-4-N-(3-methylbutyl)pyrimidine-4,6-diamine
CID 115264024
4-N-cyclopentyl-4-N-(3-methylbutyl)-6-N-propylpyrimidine-4,6-diamine
CID 80839751
4-N-[3-(dimethylamino)propyl]-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 80845621
2-[[6-(tert-butylamino)pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
CID 146233506
6-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine
CID 80904438
4-N,6-N-dimethyl-4-N-[2-(2-methylphenyl)ethyl]pyrimidine-4,6-diamine
CID 115265586

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine?
The IUPAC name of 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine (CID 107871767) is 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine?
The canonical SMILES for 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine is CNc1cc(N(CCC(C)C)CCC(C)C)ncn1.
What is the InChIKey of 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine?
The InChIKey is GTPSNVWJLFXRMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-12(2)6-8-19(9-7-13(3)4)15-10-14(16-5)17-11-18-15/h10-13H,6-9H2,1-5H3,(H,16,17,18).
What are the key properties of 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine?
6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine has a molecular weight of 264.42 g/mol, XLogP of 3.42, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-4-N,4-N-bis(3-methylbutyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 107871767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).