N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine

C11H20N4 — CID 83834295

IUPACN'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
SMILESCc1nc(C(C)C)cc(N(C)CCN)n1
InChIInChI=1S/C11H20N4/c1-8(2)10-7-11(14-9(3)13-10)15(4)6-5-12/h7-8H,5-6,12H2,1-4H3
InChIKeyODTBFXHDKJKLGW-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.30
Rot. Bonds4

About N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine

N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine (PubChem CID 83834295) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
PubChem CID83834295
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
SMILESCc1nc(C(C)C)cc(N(C)CCN)n1
InChIInChI=1S/C11H20N4/c1-8(2)10-7-11(14-9(3)13-10)15(4)6-5-12/h7-8H,5-6,12H2,1-4H3
InChIKeyODTBFXHDKJKLGW-UHFFFAOYSA-N
XLogP1.30
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-dimethyl-N-[3-(1-methylimidazol-2-yl)propyl]-6-propan-2-ylpyrimidin-4-amine
CID 50950043
N-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N,2-dimethyl-6-propan-2-ylpyrimidin-4-amine
CID 50983573
N,2-dimethyl-N-(2-morpholin-4-ylpropyl)-6-propan-2-ylpyrimidin-4-amine
CID 50958517
4-(aminomethyl)-N-butyl-N-methyl-6-propan-2-ylpyridin-2-amine
CID 113381289
4-N,2-dimethyl-4-N-(3,3,3-trifluoropropyl)pyrimidine-4,6-diamine
CID 80847662
6-(2-aminoethoxy)-N-(2-methoxyethyl)-N,2-dimethylpyrimidin-4-amine
CID 121206123
4-N-butyl-4-N,2-dimethylpyrimidine-4,6-diamine
CID 80753579
methyl 4-[2-aminoethyl(methyl)amino]-6-methylpyrimidine-2-carboxylate
CID 66285906
3-[(2,6-dimethylpyrimidin-4-yl)-methylamino]propanethioamide
CID 60922430
N'-(2,6-dimethylpyrimidin-4-yl)-N'-ethylethane-1,2-diamine
CID 63765131
N-butyl-6-chloro-N,2-dimethylpyrimidin-4-amine
CID 62483143
2-N-(6-methoxy-2-methylpyrimidin-4-yl)-2-N-methylpropane-1,2-diamine
CID 83834831

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine (CID 83834295) is N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine is Cc1nc(C(C)C)cc(N(C)CCN)n1.
What is the InChIKey of N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine?
The InChIKey is ODTBFXHDKJKLGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-8(2)10-7-11(14-9(3)13-10)15(4)6-5-12/h7-8H,5-6,12H2,1-4H3.
What are the key properties of N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine?
N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine has a molecular weight of 208.31 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-(2-methyl-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 83834295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).