4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile

C19H18N4O — CID 175628729

IUPAC4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
SMILESN#Cc1cc(OCCC2CC2)cc(Nc2ccc3cc[nH]c3c2)n1
InChIInChI=1S/C19H18N4O/c20-12-16-9-17(24-8-6-13-1-2-13)11-19(23-16)22-15-4-3-14-5-7-21-18(14)10-15/h3-5,7,9-11,13,21H,1-2,6,8H2,(H,22,23)
InChIKeyGPGMIJJWUZNSAI-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.36
Rot. Bonds6

About 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile

4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile (PubChem CID 175628729) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
PubChem CID175628729
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
SMILESN#Cc1cc(OCCC2CC2)cc(Nc2ccc3cc[nH]c3c2)n1
InChIInChI=1S/C19H18N4O/c20-12-16-9-17(24-8-6-13-1-2-13)11-19(23-16)22-15-4-3-14-5-7-21-18(14)10-15/h3-5,7,9-11,13,21H,1-2,6,8H2,(H,22,23)
InChIKeyGPGMIJJWUZNSAI-UHFFFAOYSA-N
XLogP4.36
TPSA73.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3,5-difluorophenyl)methoxy]-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 171850814
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
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-(1H-indol-6-ylamino)-4-[(1-methylindazol-5-yl)methoxy]pyridine-2-carbonitrile
CID 171850912
6-(1H-indol-6-ylamino)-4-(2,3,5-trifluorophenoxy)pyridine-2-carbonitrile
CID 171850874
4-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile
CID 164538897
N-[5-(trifluoromethoxy)-2-pyridinyl]-1H-indol-6-amine
CID 155412381
6-[(4-chloro-3-fluoro-1H-indol-6-yl)amino]-4-[2-[4-(trifluoromethyl)phenyl]ethoxy]pyridine-2-carbonitrile
CID 171850919
N-(6-tert-butyl-2-pyridinyl)-1H-indol-6-amine
CID 155412230
6-[(3-fluoro-1H-indol-6-yl)amino]-4-[2-[4-(trifluoromethyl)phenyl]propoxy]pyridine-2-carbonitrile
CID 171850898

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile?
The IUPAC name of 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile (CID 175628729) is 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile?
The canonical SMILES for 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile is N#Cc1cc(OCCC2CC2)cc(Nc2ccc3cc[nH]c3c2)n1.
What is the InChIKey of 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile?
The InChIKey is GPGMIJJWUZNSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c20-12-16-9-17(24-8-6-13-1-2-13)11-19(23-16)22-15-4-3-14-5-7-21-18(14)10-15/h3-5,7,9-11,13,21H,1-2,6,8H2,(H,22,23).
What are the key properties of 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile?
4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile has a molecular weight of 318.38 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropylethoxy)-6-(1H-indol-6-ylamino)pyridine-2-carbonitrile is sourced from PubChem (CID 175628729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).