4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine

C19H17N7 — CID 19144579

IUPAC4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine
SMILESCc1cccnc1Nc1ncnc(Nc2cccc3cccnc23)c1N
InChIInChI=1S/C19H17N7/c1-12-5-3-10-22-17(12)26-19-15(20)18(23-11-24-19)25-14-8-2-6-13-7-4-9-21-16(13)14/h2-11H,20H2,1H3,(H2,22,23,24,25,26)
InChIKeyYSXGRQYKLWEKEB-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.80
Rot. Bonds4

About 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine

4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine (PubChem CID 19144579) has the molecular formula C19H17N7 and a molecular weight of 343.39 g/mol. Its IUPAC name is 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine.

Molecular Properties

Compound Name4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine
PubChem CID19144579
Molecular FormulaC19H17N7
Molecular Weight343.39 g/mol
Exact Mass343.15
IUPAC Name4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine
SMILESCc1cccnc1Nc1ncnc(Nc2cccc3cccnc23)c1N
InChIInChI=1S/C19H17N7/c1-12-5-3-10-22-17(12)26-19-15(20)18(23-11-24-19)25-14-8-2-6-13-7-4-9-21-16(13)14/h2-11H,20H2,1H3,(H2,22,23,24,25,26)
InChIKeyYSXGRQYKLWEKEB-UHFFFAOYSA-N
XLogP3.80
TPSA101.64 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine 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-(2,5-dimethylphenyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 22547024
6-N-naphthalen-1-yl-4-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 19144720
4-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 19144759
6-N-(4-bromophenyl)-4-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 19144751
6-N-(2,4-dimethylphenyl)-4-N-(3-methyl-2-pyridinyl)pyrimidine-4,5,6-triamine
CID 19143282
3-methyl-2-N-quinolin-8-ylpyridine-2,5-diamine
CID 62476690
6-pyrrolidin-1-yl-4-N-quinolin-8-ylpyrimidine-4,5-diamine
CID 19137290
6-N-(3,5-dimethylphenyl)-4-N-(3-methyl-2-pyridinyl)pyrimidine-4,5,6-triamine
CID 22540962
4-N-quinolin-8-yl-6-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine
CID 19144821
4-N-(6-methyl-1,3-benzothiazol-2-yl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 19144764
4-N-ethyl-6-N-(3-methyl-2-pyridinyl)-4-N-naphthalen-1-ylpyrimidine-4,5,6-triamine
CID 22545791
N'-[5-amino-6-(quinolin-8-ylamino)pyrimidin-4-yl]benzohydrazide
CID 19144770

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine?
The IUPAC name of 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine (CID 19144579) is 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine.
What is the SMILES notation for 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine?
The canonical SMILES for 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine is Cc1cccnc1Nc1ncnc(Nc2cccc3cccnc23)c1N.
What is the InChIKey of 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine?
The InChIKey is YSXGRQYKLWEKEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7/c1-12-5-3-10-22-17(12)26-19-15(20)18(23-11-24-19)25-14-8-2-6-13-7-4-9-21-16(13)14/h2-11H,20H2,1H3,(H2,22,23,24,25,26).
What are the key properties of 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine?
4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine has a molecular weight of 343.39 g/mol, XLogP of 3.80, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-methyl-2-pyridinyl)-6-N-quinolin-8-ylpyrimidine-4,5,6-triamine is sourced from PubChem (CID 19144579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).