3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine

C24H25N7O — CID 176981699

IUPAC3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
SMILESNc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc2c(c1)CCC2N
InChIInChI=1S/C24H25N7O/c25-19-6-3-15-14-16(4-5-17(15)19)31-23(18-2-1-9-27-22(18)26)28-20-7-8-21(29-24(20)31)30-10-12-32-13-11-30/h1-2,4-5,7-9,14,19H,3,6,10-13,25H2,(H2,26,27)
InChIKeyOCIYJNSETMZECF-UHFFFAOYSA-N
MW427.51 g/mol
LogP2.85
Rot. Bonds3

About 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine

3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine (PubChem CID 176981699) has the molecular formula C24H25N7O and a molecular weight of 427.51 g/mol. Its IUPAC name is 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
PubChem CID176981699
Molecular FormulaC24H25N7O
Molecular Weight427.51 g/mol
Exact Mass427.21
IUPAC Name3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
SMILESNc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc2c(c1)CCC2N
InChIInChI=1S/C24H25N7O/c25-19-6-3-15-14-16(4-5-17(15)19)31-23(18-2-1-9-27-22(18)26)28-20-7-8-21(29-24(20)31)30-10-12-32-13-11-30/h1-2,4-5,7-9,14,19H,3,6,10-13,25H2,(H2,26,27)
InChIKeyOCIYJNSETMZECF-UHFFFAOYSA-N
XLogP2.85
TPSA108.11 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.51
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

3-[3-[(1S)-1-amino-2,3-dihydro-1H-inden-5-yl]-5-(difluoromethyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176982008
3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176982007
3-[3-[(1S)-1-(methylamino)-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272462
1-[4-[[5-[2-(2-amino-3-pyridinyl)-5-(4-fluoropiperidin-1-yl)imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1H-inden-1-yl]amino]piperidin-1-yl]prop-2-en-1-one
CID 176981748
3-[3-[1-[(1,1-dioxothian-4-yl)amino]-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176699649
3-[3-[4-(aminomethyl)phenyl]-5-piperidin-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine;hydrochloride
CID 67305562
3-[3-[(1S)-1-[4-(oxetan-3-yl)triazol-1-yl]-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272579
3-[5-pyrazol-1-yl-3-[(1S)-1-[(1-pyridin-3-ylpiperidin-4-yl)amino]-2,3-dihydro-1H-inden-5-yl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272591
3-[5-pyrazol-1-yl-3-[1-[(1-pyridin-2-ylpyrrolidin-3-yl)amino]-2,3-dihydro-1H-inden-5-yl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 176699567
1-[4-[[5-[2-(2-amino-3-pyridinyl)-5-[3-(oxan-4-yl)pyrazol-1-yl]imidazo[4,5-b]pyridin-3-yl]-2,3-dihydro-1H-inden-1-yl]amino]piperidin-1-yl]prop-2-en-1-one
CID 176981927
3-[3-[(1S)-1-[(1-methylpyrazol-3-yl)methylamino]-2,3-dihydro-1H-inden-5-yl]-5-pyrazol-1-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177272675
2-[[1-[[4-[2-(2-amino-3-pyridinyl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]piperidin-4-yl]amino]-4,5-dihydropyrimidine-6-carbonitrile
CID 171494826

Frequently Asked Questions

What is the IUPAC name of 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
The IUPAC name of 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine (CID 176981699) is 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine.
What is the SMILES notation for 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
The canonical SMILES for 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine is Nc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc2c(c1)CCC2N.
What is the InChIKey of 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
The InChIKey is OCIYJNSETMZECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N7O/c25-19-6-3-15-14-16(4-5-17(15)19)31-23(18-2-1-9-27-22(18)26)28-20-7-8-21(29-24(20)31)30-10-12-32-13-11-30/h1-2,4-5,7-9,14,19H,3,6,10-13,25H2,(H2,26,27).
What are the key properties of 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine has a molecular weight of 427.51 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(1-amino-2,3-dihydro-1H-inden-5-yl)-5-morpholin-4-ylimidazo[4,5-b]pyridin-2-yl]pyridin-2-amine is sourced from PubChem (CID 176981699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).