7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine

C20H21N5O3 — CID 11222699

IUPAC7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine
SMILESCOc1cc(Nc2ncc3c(n2)N(c2ccccn2)CC3)cc(OC)c1OC
InChIInChI=1S/C20H21N5O3/c1-26-15-10-14(11-16(27-2)18(15)28-3)23-20-22-12-13-7-9-25(19(13)24-20)17-6-4-5-8-21-17/h4-6,8,10-12H,7,9H2,1-3H3,(H,22,23,24)
InChIKeyDCJLVDPCLZBHMK-UHFFFAOYSA-N
MW379.42 g/mol
LogP3.34
Rot. Bonds6

About 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine

7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine (PubChem CID 11222699) has the molecular formula C20H21N5O3 and a molecular weight of 379.42 g/mol. Its IUPAC name is 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine
PubChem CID11222699
Molecular FormulaC20H21N5O3
Molecular Weight379.42 g/mol
Exact Mass379.16
IUPAC Name7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine
SMILESCOc1cc(Nc2ncc3c(n2)N(c2ccccn2)CC3)cc(OC)c1OC
InChIInChI=1S/C20H21N5O3/c1-26-15-10-14(11-16(27-2)18(15)28-3)23-20-22-12-13-7-9-25(19(13)24-20)17-6-4-5-8-21-17/h4-6,8,10-12H,7,9H2,1-3H3,(H,22,23,24)
InChIKeyDCJLVDPCLZBHMK-UHFFFAOYSA-N
XLogP3.34
TPSA81.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine 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

2,4-Diamino-5-Methyl-6-[(3,4,5-Trimethoxy-N-Methylanilino)Methyl]Pyrido[2,3-D]Pyrimidine
CID 447815
N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
CID 9822610
7-Pyridin-2-YL-N-(3,4,5-trimethoxyphenyl)-7H-pyrrolo(2,3-D)pyrimidin-2-amine
CID 11957393
5-Methyl-6-[(3,4,5-trimethoxyanilino)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 456204
5-[8-(3,5-Dimethoxyphenyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidine-2,4-diamine
CID 5271336
2,4-Disubstituted Pyrimidine 2h
CID 5329421
5-methyl-7-phenyl-N-(3,4,5-trimethoxyphenyl)imidazo[5,1-f][1,2,4]triazin-2-amine
CID 9886746
Sdccggsk-0000152.P001
CID 11163861
Keratinocyte Differentiation Inducer
CID 11453158
N*1*-{5-[2-(3,4,5-Trimethoxy-phenylamino)-pyrimidin-4-yl]-pyridin-2-yl}-ethane-1,2-diamine
CID 15550318
4-(2-Anilinopyridin-3-Yl)-N-(3,4,5-Trimethoxyphenyl)-1,3,5-Triazin-2-Amine
CID 16040288
7-(3-methoxyphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 23646630

Frequently Asked Questions

What is the IUPAC name of 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine?
The IUPAC name of 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine (CID 11222699) is 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine is COc1cc(Nc2ncc3c(n2)N(c2ccccn2)CC3)cc(OC)c1OC.
What is the InChIKey of 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine?
The InChIKey is DCJLVDPCLZBHMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O3/c1-26-15-10-14(11-16(27-2)18(15)28-3)23-20-22-12-13-7-9-25(19(13)24-20)17-6-4-5-8-21-17/h4-6,8,10-12H,7,9H2,1-3H3,(H,22,23,24).
What are the key properties of 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine?
7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine has a molecular weight of 379.42 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 11222699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).