N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine

C26H23N5O — CID 70999478

IUPACN-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine
SMILESc1ccc(N2CCc3cc(Oc4ccnc(Nc5ccc6c(c5)CCC6)n4)ccc32)nc1
InChIInChI=1S/C26H23N5O/c1-2-13-27-24(6-1)31-15-12-20-17-22(9-10-23(20)31)32-25-11-14-28-26(30-25)29-21-8-7-18-4-3-5-19(18)16-21/h1-2,6-11,13-14,16-17H,3-5,12,15H2,(H,28,29,30)
InChIKeyGXOQKCSEQJFGRK-UHFFFAOYSA-N
MW421.50 g/mol
LogP5.59
Rot. Bonds5

About N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine

N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine (PubChem CID 70999478) has the molecular formula C26H23N5O and a molecular weight of 421.50 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine
PubChem CID70999478
Molecular FormulaC26H23N5O
Molecular Weight421.50 g/mol
Exact Mass421.19
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine
SMILESc1ccc(N2CCc3cc(Oc4ccnc(Nc5ccc6c(c5)CCC6)n4)ccc32)nc1
InChIInChI=1S/C26H23N5O/c1-2-13-27-24(6-1)31-15-12-20-17-22(9-10-23(20)31)32-25-11-14-28-26(30-25)29-21-8-7-18-4-3-5-19(18)16-21/h1-2,6-11,13-14,16-17H,3-5,12,15H2,(H,28,29,30)
InChIKeyGXOQKCSEQJFGRK-UHFFFAOYSA-N
XLogP5.59
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.50
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]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

N-(4-fluoro-3-methylphenyl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine
CID 70999481
4-[[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]amino]benzenesulfonamide
CID 90438115
4-[[4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]amino]-N-methylbenzenesulfonamide
CID 58432909
4-[[4-(2,3-dihydroindol-1-yl)pyrimidin-2-yl]amino]benzonitrile
CID 112902261
4-(4-fluorophenoxy)-N-(6-pyrrolidin-1-yl-3-pyridinyl)pyrimidin-2-amine
CID 56575278
N-[4-(4-methylpiperazin-1-yl)phenyl]-4-phenoxypyrimidin-2-amine
CID 172514967
2-[3-[[4-(1-pyridin-2-ylindol-5-yl)oxypyrimidin-2-yl]amino]anilino]acetamide
CID 68989992
N-[4-[[4-(2,3-dihydroindol-1-yl)pyrimidin-2-yl]amino]phenyl]acetamide
CID 112902218
N-(4-bromo-3-methylphenyl)-4-(3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine
CID 112902378
N-[6-(aziridin-1-yl)-3-pyridinyl]-4-(5-methylsulfonyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine
CID 10136144
2-(2,3-dihydro-1H-inden-5-ylamino)pyrimidine-4-carbothioamide
CID 107546320
1-[2-(3,5-dimethoxyanilino)pyrimidin-4-yl]-3,4-dihydro-2H-quinolin-6-ol
CID 91284249

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine (CID 70999478) is N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine is c1ccc(N2CCc3cc(Oc4ccnc(Nc5ccc6c(c5)CCC6)n4)ccc32)nc1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine?
The InChIKey is GXOQKCSEQJFGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N5O/c1-2-13-27-24(6-1)31-15-12-20-17-22(9-10-23(20)31)32-25-11-14-28-26(30-25)29-21-8-7-18-4-3-5-19(18)16-21/h1-2,6-11,13-14,16-17H,3-5,12,15H2,(H,28,29,30).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine?
N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine has a molecular weight of 421.50 g/mol, XLogP of 5.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-4-[(1-pyridin-2-yl-2,3-dihydroindol-5-yl)oxy]pyrimidin-2-amine is sourced from PubChem (CID 70999478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).