2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile

C10H15N5 — CID 110383441

IUPAC2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile
SMILESCc1cc(C#N)nc(NCCN(C)C)n1
InChIInChI=1S/C10H15N5/c1-8-6-9(7-11)14-10(13-8)12-4-5-15(2)3/h6H,4-5H2,1-3H3,(H,12,13,14)
InChIKeyWEJFICZAGUHBBA-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.63
Rot. Bonds4

About 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile

2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile (PubChem CID 110383441) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile
PubChem CID110383441
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile
SMILESCc1cc(C#N)nc(NCCN(C)C)n1
InChIInChI=1S/C10H15N5/c1-8-6-9(7-11)14-10(13-8)12-4-5-15(2)3/h6H,4-5H2,1-3H3,(H,12,13,14)
InChIKeyWEJFICZAGUHBBA-UHFFFAOYSA-N
XLogP0.63
TPSA64.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(hexylamino)-6-methylpyrimidine-4-carbonitrile
CID 107544597
2-(3-methoxypropylamino)-6-methylpyrimidine-4-carbonitrile
CID 110383439
6-methyl-2-(2-methylsulfinylethylamino)pyrimidine-4-carbonitrile
CID 107545228
6-methyl-2-(2-methylbutan-2-ylamino)pyrimidine-4-carbonitrile
CID 107543261
2-(3-hydroxypentylamino)-6-methylpyrimidine-4-carbonitrile
CID 107545273
6-methyl-2-(3-methylsulfinylpropylamino)pyrimidine-4-carbonitrile
CID 107545250
6-methyl-2-[2-(4-methylpiperazin-1-yl)ethylamino]pyrimidine-4-carbonitrile
CID 107551946
6-methyl-2-(3-propoxypropylamino)pyrimidine-4-carbonitrile
CID 107545023
2-[2-(4-fluorophenyl)ethylamino]-6-methylpyrimidine-4-carbonitrile
CID 110383464
2-[2-(4-fluoro-2-methylphenyl)ethylamino]-6-methylpyrimidine-4-carbonitrile
CID 107544870
2-[[1-(dimethylamino)-4-methylpentan-2-yl]amino]-6-methylpyrimidine-4-carbonitrile
CID 107544009
2-[2-(2-fluorophenyl)ethylamino]-6-methylpyrimidine-4-carbonitrile
CID 110383463

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile?
The IUPAC name of 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile (CID 110383441) is 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile.
What is the SMILES notation for 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile?
The canonical SMILES for 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile is Cc1cc(C#N)nc(NCCN(C)C)n1.
What is the InChIKey of 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile?
The InChIKey is WEJFICZAGUHBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-8-6-9(7-11)14-10(13-8)12-4-5-15(2)3/h6H,4-5H2,1-3H3,(H,12,13,14).
What are the key properties of 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile?
2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile has a molecular weight of 205.26 g/mol, XLogP of 0.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carbonitrile is sourced from PubChem (CID 110383441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).