6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine

C12H15N5 — CID 115265672

IUPAC6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine
SMILESCCNc1cc(N(C)c2ccccn2)ncn1
InChIInChI=1S/C12H15N5/c1-3-13-10-8-12(16-9-15-10)17(2)11-6-4-5-7-14-11/h4-9H,3H2,1-2H3,(H,13,15,16)
InChIKeyYNMQYNJNAWTDSP-UHFFFAOYSA-N
MW229.29 g/mol
LogP2.07
Rot. Bonds4

About 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine

6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine (PubChem CID 115265672) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine
PubChem CID115265672
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine
SMILESCCNc1cc(N(C)c2ccccn2)ncn1
InChIInChI=1S/C12H15N5/c1-3-13-10-8-12(16-9-15-10)17(2)11-6-4-5-7-14-11/h4-9H,3H2,1-2H3,(H,13,15,16)
InChIKeyYNMQYNJNAWTDSP-UHFFFAOYSA-N
XLogP2.07
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-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

N-methyl-N-pyridin-2-ylpyridin-2-amine
CID 14365053
N-ethyl-6-pyridin-2-ylsulfanylpyrimidin-4-amine
CID 80882443
4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine
CID 80774806
4-N,4-N-dipropyl-6-N-(pyridin-2-ylmethyl)pyrimidine-4,6-diamine
CID 112860603
4-N-methyl-4-N-phenyl-6-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 112860925
6-N-ethyl-4-N-[(4-methoxyphenyl)methyl]-4-N-methylpyrimidine-4,6-diamine
CID 80794827
6-N-ethyl-4-N-methyl-4-N-(1-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 80804570
4-N,6-N-diethyl-4-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 80809064
4-N-methyl-4-N-phenyl-6-N-[(2-pyridin-2-ylpyrimidin-4-yl)methyl]pyrimidine-4,6-diamine
CID 166272871
6-N-ethyl-4-N-methyl-4-N-[(1-methylimidazol-2-yl)methyl]pyrimidine-4,6-diamine
CID 80831186
6-N-benzyl-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 102080311
2-[cyanomethyl-[6-(ethylamino)pyrimidin-4-yl]amino]acetonitrile
CID 80753559

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine (CID 115265672) is 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine is CCNc1cc(N(C)c2ccccn2)ncn1.
What is the InChIKey of 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine?
The InChIKey is YNMQYNJNAWTDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-3-13-10-8-12(16-9-15-10)17(2)11-6-4-5-7-14-11/h4-9H,3H2,1-2H3,(H,13,15,16).
What are the key properties of 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine?
6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine has a molecular weight of 229.29 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-4-N-methyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine is sourced from PubChem (CID 115265672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).