2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile

C19H18N4 — CID 70413535

IUPAC2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
SMILESCc1nc2c(NC3CCc4ccccc43)cccn2c1CC#N
InChIInChI=1S/C19H18N4/c1-13-18(10-11-20)23-12-4-7-17(19(23)21-13)22-16-9-8-14-5-2-3-6-15(14)16/h2-7,12,16,22H,8-10H2,1H3
InChIKeyARPAQURDYGEWGD-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.81
Rot. Bonds3

About 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile

2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile (PubChem CID 70413535) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile.

Molecular Properties

Compound Name2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
PubChem CID70413535
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
SMILESCc1nc2c(NC3CCc4ccccc43)cccn2c1CC#N
InChIInChI=1S/C19H18N4/c1-13-18(10-11-20)23-12-4-7-17(19(23)21-13)22-16-9-8-14-5-2-3-6-15(14)16/h2-7,12,16,22H,8-10H2,1H3
InChIKeyARPAQURDYGEWGD-UHFFFAOYSA-N
XLogP3.81
TPSA53.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile with MolForge

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Related Compounds

2-[8-[[(1S,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]oxy]-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 57177844
1-[8-(2,3-dihydro-1H-inden-1-ylamino)-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one;hydrochloride
CID 69229090
N-(2,3-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43196442
[8-(2,3-dihydro-1H-inden-1-yloxy)-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 70404568
N-(2-ethoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43191712
2-[3,5-dimethyl-4-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)pyrazol-1-yl]acetonitrile
CID 167963371
2,3-dihydro-1H-inden-1-ylcyanamide
CID 62483491
N-(2,3-dihydro-1H-inden-1-yl)-4-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 154795334
[8-(2,3-dihydro-1H-inden-1-ylmethyl)-2-methylimidazo[1,2-a]pyrazin-3-yl]methanol
CID 70414684
4-amino-2-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-6-ethylpyrimidine-5-carbonitrile
CID 67458087
N-(5-fluoro-2-methylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43195451
N-(2,3-dihydro-1H-inden-1-yl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 59848156

Frequently Asked Questions

What is the IUPAC name of 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The IUPAC name of 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile (CID 70413535) is 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile.
What is the SMILES notation for 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The canonical SMILES for 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile is Cc1nc2c(NC3CCc4ccccc43)cccn2c1CC#N.
What is the InChIKey of 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The InChIKey is ARPAQURDYGEWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4/c1-13-18(10-11-20)23-12-4-7-17(19(23)21-13)22-16-9-8-14-5-2-3-6-15(14)16/h2-7,12,16,22H,8-10H2,1H3.
What are the key properties of 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile has a molecular weight of 302.38 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(2,3-dihydro-1H-inden-1-ylamino)-2-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile is sourced from PubChem (CID 70413535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).