2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine

C14H18N6 — CID 167959589

IUPAC2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine
SMILESCNc1ccc(Nc2ncnc3c2CN(C)CC3)cn1
InChIInChI=1S/C14H18N6/c1-15-13-4-3-10(7-16-13)19-14-11-8-20(2)6-5-12(11)17-9-18-14/h3-4,7,9H,5-6,8H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKeyXPSVVFRZAFIKET-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.64
Rot. Bonds3

About 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine

2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine (PubChem CID 167959589) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine
PubChem CID167959589
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine
SMILESCNc1ccc(Nc2ncnc3c2CN(C)CC3)cn1
InChIInChI=1S/C14H18N6/c1-15-13-4-3-10(7-16-13)19-14-11-8-20(2)6-5-12(11)17-9-18-14/h3-4,7,9H,5-6,8H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKeyXPSVVFRZAFIKET-UHFFFAOYSA-N
XLogP1.64
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine with MolForge

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Related Compounds

6-methyl-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
CID 138014265
2-methyl-1-[4-(4-methylanilino)-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-7-yl]propan-1-one
CID 97410102
2-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)propanenitrile
CID 112708628
1-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)propan-2-one
CID 83859099
4-[(3aR,7aR)-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 129418475
N'-(7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 83833878
N-(6-propan-2-ylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-1,2-oxazol-3-amine
CID 25114408
[6-(methylamino)-3-pyridinyl]urea
CID 130725566
4-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]-6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 129427639
N-(6-methylsulfonyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-yl)quinolin-3-amine
CID 58478363
N'-(7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)propane-1,3-diamine
CID 83838471
2-fluoro-4-(5,6,7,8-tetrahydroquinazolin-4-ylamino)benzoic acid
CID 107793542

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine?
The IUPAC name of 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine (CID 167959589) is 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine.
What is the SMILES notation for 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine?
The canonical SMILES for 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine is CNc1ccc(Nc2ncnc3c2CN(C)CC3)cn1.
What is the InChIKey of 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine?
The InChIKey is XPSVVFRZAFIKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-15-13-4-3-10(7-16-13)19-14-11-8-20(2)6-5-12(11)17-9-18-14/h3-4,7,9H,5-6,8H2,1-2H3,(H,15,16)(H,17,18,19).
What are the key properties of 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine?
2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine has a molecular weight of 270.34 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-5-N-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyridine-2,5-diamine is sourced from PubChem (CID 167959589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).