6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile

C23H18N6O — CID 171850912

IUPAC6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile
SMILESCn1ncc2cc(COc3cc(C#N)nc(Nc4ccc5cc[nH]c5c4)c3)ccc21
InChIInChI=1S/C23H18N6O/c1-29-22-5-2-15(8-17(22)13-26-29)14-30-20-9-19(12-24)28-23(11-20)27-18-4-3-16-6-7-25-21(16)10-18/h2-11,13,25H,14H2,1H3,(H,27,28)
InChIKeyNEIPILIBGHFHBI-UHFFFAOYSA-N
MW394.44 g/mol
LogP4.64
Rot. Bonds5

About 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile

6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile (PubChem CID 171850912) has the molecular formula C23H18N6O and a molecular weight of 394.44 g/mol. Its IUPAC name is 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile
PubChem CID171850912
Molecular FormulaC23H18N6O
Molecular Weight394.44 g/mol
Exact Mass394.15
IUPAC Name6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile
SMILESCn1ncc2cc(COc3cc(C#N)nc(Nc4ccc5cc[nH]c5c4)c3)ccc21
InChIInChI=1S/C23H18N6O/c1-29-22-5-2-15(8-17(22)13-26-29)14-30-20-9-19(12-24)28-23(11-20)27-18-4-3-16-6-7-25-21(16)10-18/h2-11,13,25H,14H2,1H3,(H,27,28)
InChIKeyNEIPILIBGHFHBI-UHFFFAOYSA-N
XLogP4.64
TPSA91.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.44
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile with MolForge

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Related Compounds

4-[(3,5-difluorophenyl)methoxy]-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 171850814
4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 175628729
6-(1H-indol-6-ylamino)-4-[2-(2-methyl-1,3-thiazol-5-yl)ethoxy]pyridine-2-carbonitrile
CID 171850799
6-(1H-indol-6-ylamino)-4-[[2-(trifluoromethyl)phenyl]methoxy]pyridine-2-carbonitrile
CID 171850947
6-(1H-indol-6-ylamino)-4-(2,3,5-trifluorophenoxy)pyridine-2-carbonitrile
CID 171850874
4-[4-fluoro-3-(trifluoromethyl)phenoxy]-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 171850779
6-(1H-indol-6-ylamino)-4-[3-(trifluoromethyl)phenoxy]pyridine-2-carbonitrile
CID 171850841
6-[(4-chloro-1H-indol-6-yl)amino]-4-[(1,3-dimethylindazol-5-yl)amino]pyridine-2-carbonitrile
CID 164538913
4-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 164538897
N-methyl-1-(1-methylindazol-5-yl)methanamine
CID 82598913
N-[5-(trifluoromethoxy)-2-pyridinyl]-1H-indol-6-amine
CID 155412381
6-[(4-chlorophenyl)methoxy]-1H-indole
CID 154090222

Frequently Asked Questions

What is the IUPAC name of 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile?
The IUPAC name of 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile (CID 171850912) is 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile.
What is the SMILES notation for 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile?
The canonical SMILES for 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile is Cn1ncc2cc(COc3cc(C#N)nc(Nc4ccc5cc[nH]c5c4)c3)ccc21.
What is the InChIKey of 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile?
The InChIKey is NEIPILIBGHFHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N6O/c1-29-22-5-2-15(8-17(22)13-26-29)14-30-20-9-19(12-24)28-23(11-20)27-18-4-3-16-6-7-25-21(16)10-18/h2-11,13,25H,14H2,1H3,(H,27,28).
What are the key properties of 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile?
6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile has a molecular weight of 394.44 g/mol, XLogP of 4.64, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile is sourced from PubChem (CID 171850912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).