2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine

C20H18N6 — CID 154806379

IUPAC2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine
SMILESNc1nc(N2CCc3c(cnn3-c3ccccc3)C2)nc2ccccc12
InChIInChI=1S/C20H18N6/c21-19-16-8-4-5-9-17(16)23-20(24-19)25-11-10-18-14(13-25)12-22-26(18)15-6-2-1-3-7-15/h1-9,12H,10-11,13H2,(H2,21,23,24)
InChIKeyBWCMHGDIZNBAJQ-UHFFFAOYSA-N
MW342.41 g/mol
LogP2.96
Rot. Bonds2

About 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine

2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine (PubChem CID 154806379) has the molecular formula C20H18N6 and a molecular weight of 342.41 g/mol. Its IUPAC name is 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine.

Molecular Properties

Compound Name2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine
PubChem CID154806379
Molecular FormulaC20H18N6
Molecular Weight342.41 g/mol
Exact Mass342.16
IUPAC Name2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine
SMILESNc1nc(N2CCc3c(cnn3-c3ccccc3)C2)nc2ccccc12
InChIInChI=1S/C20H18N6/c21-19-16-8-4-5-9-17(16)23-20(24-19)25-11-10-18-14(13-25)12-22-26(18)15-6-2-1-3-7-15/h1-9,12H,10-11,13H2,(H2,21,23,24)
InChIKeyBWCMHGDIZNBAJQ-UHFFFAOYSA-N
XLogP2.96
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.41
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-phenylpiperazin-1-yl)quinazolin-4-amine;hydrochloride
CID 52995741
2-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)quinazolin-4-amine
CID 133422406
2-thiomorpholin-4-ylquinazolin-4-amine
CID 123991658
2-(1-oxo-3,5-dihydro-2H-1λ4,4-benzothiazepin-4-yl)quinazolin-4-amine
CID 175883645
N-[5-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)-2-pyridinyl]acetamide
CID 171678951
6-phenyl-7,8-dihydro-5H-1,6-naphthyridine-2,3-diamine
CID 171842660
2-(4-pyridin-2-ylpiperazin-1-yl)quinazolin-4-amine
CID 4907991
2-[4-(2-fluorophenyl)piperazin-1-yl]quinazolin-4-amine;hydrochloride
CID 52995833
1-phenyl-5,6,7,8-tetrahydro-4H-pyrazolo[4,5-d]azepine
CID 84679841
2-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]quinazolin-4-amine
CID 154857857
2-(8-methyl-5-oxa-2,8-diazaspiro[3.5]nonan-2-yl)quinazolin-4-amine
CID 162496353
2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenylquinazolin-4-amine
CID 71690567

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine?
The IUPAC name of 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine (CID 154806379) is 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine.
What is the SMILES notation for 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine?
The canonical SMILES for 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine is Nc1nc(N2CCc3c(cnn3-c3ccccc3)C2)nc2ccccc12.
What is the InChIKey of 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine?
The InChIKey is BWCMHGDIZNBAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6/c21-19-16-8-4-5-9-17(16)23-20(24-19)25-11-10-18-14(13-25)12-22-26(18)15-6-2-1-3-7-15/h1-9,12H,10-11,13H2,(H2,21,23,24).
What are the key properties of 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine?
2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine has a molecular weight of 342.41 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)quinazolin-4-amine is sourced from PubChem (CID 154806379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).