6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile

C17H13N7O — CID 68751535

IUPAC6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile
SMILESN#Cc1n[nH]c2cc(Nc3nc(NC4CC4)c4occc4n3)ccc12
InChIInChI=1S/C17H13N7O/c18-8-14-11-4-3-10(7-13(11)23-24-14)20-17-21-12-5-6-25-15(12)16(22-17)19-9-1-2-9/h3-7,9H,1-2H2,(H,23,24)(H2,19,20,21,22)
InChIKeyNPYFWCQXNCESQK-UHFFFAOYSA-N
MW331.34 g/mol
LogP3.29
Rot. Bonds4

About 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile

6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile (PubChem CID 68751535) has the molecular formula C17H13N7O and a molecular weight of 331.34 g/mol. Its IUPAC name is 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile.

Molecular Properties

Compound Name6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile
PubChem CID68751535
Molecular FormulaC17H13N7O
Molecular Weight331.34 g/mol
Exact Mass331.12
IUPAC Name6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile
SMILESN#Cc1n[nH]c2cc(Nc3nc(NC4CC4)c4occc4n3)ccc12
InChIInChI=1S/C17H13N7O/c18-8-14-11-4-3-10(7-13(11)23-24-14)20-17-21-12-5-6-25-15(12)16(22-17)19-9-1-2-9/h3-7,9H,1-2H2,(H,23,24)(H2,19,20,21,22)
InChIKeyNPYFWCQXNCESQK-UHFFFAOYSA-N
XLogP3.29
TPSA115.45 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.34
LogP ≤ 53.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile with MolForge

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Related Compounds

N~4~-Cyclopropyl-N~2~-(3-Methyl-1h-Indazol-6-Yl)furo[3,2-D]pyrimidine-2,4-Diamine
CID 67130050
N-(7-methyl-1H-indazol-4-yl)-2-(pyrimidin-2-yl)furo[2,3-c]pyridin-3-amine
CID 53319339
N-(1H-indazol-4-yl)-2-(pyrimidin-2-yl)furo[2,3-c]pyridin-3-amine
CID 53323287
N-(7-fluoro-1H-indazol-4-yl)-2-(pyrimidin-2-yl)furo[2,3-c]pyridin-3-amine
CID 53324074
N2-(1H-indazol-6-yl)-N4-(2,2,2-trifluoroethyl)furo[3,2-d]pyrimidine-2,4-diamine
CID 67129970
N-propan-2-yl-2-[3-[4-[4-(1H-pyrazol-4-yl)anilino]furo[3,2-d]pyrimidin-2-yl]phenoxy]acetamide
CID 124159097
2-(4-aminopiperidin-1-yl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)furo[3,2-d]pyrimidin-4-amine
CID 122178550
2-N-(3-methyl-2H-indazol-6-yl)-4-N-(2,2,2-trifluoroethyl)furo[3,2-d]pyrimidine-2,4-diamine
CID 137644151
8-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-5,5-dimethyl-3,4-dihydro-1H-1-benzazepin-2-one
CID 137662049
3-(furo[3,2-d]pyrimidin-4-ylamino)-6,6-dimethyl-N-[(1S,2R)-2-phenylcyclopropyl]-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide
CID 11517572
N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-(furo[3,2-d]pyrimidin-4-ylamino)-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide
CID 59474190
3-(4-{[2-(Pyrimidin-2-Yl)furo[2,3-C]pyridin-3-Yl]amino}-1h-Indazol-3-Yl)propan-1-Ol
CID 49849971

Frequently Asked Questions

What is the IUPAC name of 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile?
The IUPAC name of 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile (CID 68751535) is 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile.
What is the SMILES notation for 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile?
The canonical SMILES for 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile is N#Cc1n[nH]c2cc(Nc3nc(NC4CC4)c4occc4n3)ccc12.
What is the InChIKey of 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile?
The InChIKey is NPYFWCQXNCESQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N7O/c18-8-14-11-4-3-10(7-13(11)23-24-14)20-17-21-12-5-6-25-15(12)16(22-17)19-9-1-2-9/h3-7,9H,1-2H2,(H,23,24)(H2,19,20,21,22).
What are the key properties of 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile?
6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile has a molecular weight of 331.34 g/mol, XLogP of 3.29, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[4-(cyclopropylamino)furo[3,2-d]pyrimidin-2-yl]amino]-1H-indazole-3-carbonitrile is sourced from PubChem (CID 68751535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).