8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine

C17H17N5 — CID 135368386

IUPAC8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
SMILESCc1nccc2c(NC3(C)CC3)nc(-c3ccncc3)nc12
InChIInChI=1S/C17H17N5/c1-11-14-13(5-10-19-11)16(22-17(2)6-7-17)21-15(20-14)12-3-8-18-9-4-12/h3-5,8-10H,6-7H2,1-2H3,(H,20,21,22)
InChIKeyNCURZWASYVOQOD-UHFFFAOYSA-N
MW291.36 g/mol
LogP3.36
Rot. Bonds3

About 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine

8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine (PubChem CID 135368386) has the molecular formula C17H17N5 and a molecular weight of 291.36 g/mol. Its IUPAC name is 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
PubChem CID135368386
Molecular FormulaC17H17N5
Molecular Weight291.36 g/mol
Exact Mass291.15
IUPAC Name8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine
SMILESCc1nccc2c(NC3(C)CC3)nc(-c3ccncc3)nc12
InChIInChI=1S/C17H17N5/c1-11-14-13(5-10-19-11)16(22-17(2)6-7-17)21-15(20-14)12-3-8-18-9-4-12/h3-5,8-10H,6-7H2,1-2H3,(H,20,21,22)
InChIKeyNCURZWASYVOQOD-UHFFFAOYSA-N
XLogP3.36
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methylcyclopropyl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrido[3,4-d]pyrimidin-4-amine
CID 135368330
N-(1-methylcyclopropyl)-2-(1,3-oxazol-5-yl)pyrido[3,4-d]pyrimidin-4-amine
CID 135368048
2-(1H-imidazol-5-yl)-N-(1-methylcyclopropyl)pyrido[3,4-d]pyrimidin-4-amine
CID 135390677
5,6-dimethyl-N-[[1-(methylsulfonylmethyl)cyclopropyl]methyl]-2-pyridin-4-ylpyrimidin-4-amine
CID 133344239
5,6-dimethyl-2-pyridin-4-yl-N-(2,2,5,5-tetramethyloxolan-3-yl)pyrimidin-4-amine
CID 133439232
N-[(1-methoxycyclobutyl)methyl]-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
CID 133460026
2,4-dimethyl-3-pyridin-4-ylpyridine
CID 90999658
5,7-dimethyl-3-pyridin-4-ylpyrido[3,4-e][1,2,4]triazin-8-amine
CID 516630
1-N-[8-(4-methylpiperazin-1-yl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-yl]-3-phenylpropane-1,2-diamine
CID 90100432
1-N-[8-(3-methylphenyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-yl]-3-phenylpropane-1,2-diamine
CID 134312493
4-(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidine-8-carbonitrile
CID 167233268
N-ethyl-6-methyl-5-propan-2-yl-2-pyridin-4-ylpyrimidin-4-amine
CID 62913834

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine (CID 135368386) is 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine is Cc1nccc2c(NC3(C)CC3)nc(-c3ccncc3)nc12.
What is the InChIKey of 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is NCURZWASYVOQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5/c1-11-14-13(5-10-19-11)16(22-17(2)6-7-17)21-15(20-14)12-3-8-18-9-4-12/h3-5,8-10H,6-7H2,1-2H3,(H,20,21,22).
What are the key properties of 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine?
8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 291.36 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(1-methylcyclopropyl)-2-pyridin-4-ylpyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 135368386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).