6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine

C11H20N4 — CID 46225978

IUPAC6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine
SMILESCc1cc(NC(C)C)nc(NC(C)C)n1
InChIInChI=1S/C11H20N4/c1-7(2)12-10-6-9(5)14-11(15-10)13-8(3)4/h6-8H,1-5H3,(H2,12,13,14,15)
InChIKeyJKLDAVVLWFDOHT-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.43
Rot. Bonds4

About 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine

6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine (PubChem CID 46225978) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine
PubChem CID46225978
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine
SMILESCc1cc(NC(C)C)nc(NC(C)C)n1
InChIInChI=1S/C11H20N4/c1-7(2)12-10-6-9(5)14-11(15-10)13-8(3)4/h6-8H,1-5H3,(H2,12,13,14,15)
InChIKeyJKLDAVVLWFDOHT-UHFFFAOYSA-N
XLogP2.43
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Crimidine
CID 10813
2,6-Dimethyl-4-aminopyrimidine
CID 68039
2,4-Dimethyl-6-(piperazin-1-yl)pyrimidine
CID 4778269
2-Chloro-6-methylpyrimidin-4-amine
CID 312629
6-Methylpyrimidin-4-amine
CID 572852
4-Methyl-2,6-di(piperidin-1-yl)pyrimidine
CID 893737
4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 3228743
4-butyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24992077
4-methyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24994945
4-Ethyl-6-[3-(methylamino)-1-azetidinyl]-2-pyrimidinamine
CID 42623567
4-ethyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 42624149
2-N,4-N-dicyclohexyl-6-methylpyrimidine-2,4-diamine
CID 46225979

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine?
The IUPAC name of 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine (CID 46225978) is 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine.
What is the SMILES notation for 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine?
The canonical SMILES for 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine is Cc1cc(NC(C)C)nc(NC(C)C)n1.
What is the InChIKey of 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine?
The InChIKey is JKLDAVVLWFDOHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-7(2)12-10-6-9(5)14-11(15-10)13-8(3)4/h6-8H,1-5H3,(H2,12,13,14,15).
What are the key properties of 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine?
6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine has a molecular weight of 208.31 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine is sourced from PubChem (CID 46225978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).