6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide

C16H14ClN3O — CID 18940889

IUPAC6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
SMILESC=Cc1cc2c(cc1Cl)N(C(=O)Nc1cccnc1)CC2
InChIInChI=1S/C16H14ClN3O/c1-2-11-8-12-5-7-20(15(12)9-14(11)17)16(21)19-13-4-3-6-18-10-13/h2-4,6,8-10H,1,5,7H2,(H,19,21)
InChIKeyILEVMOFZKXQODL-UHFFFAOYSA-N
MW299.76 g/mol
LogP3.97
Rot. Bonds2

About 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide

6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide (PubChem CID 18940889) has the molecular formula C16H14ClN3O and a molecular weight of 299.76 g/mol. Its IUPAC name is 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
PubChem CID18940889
Molecular FormulaC16H14ClN3O
Molecular Weight299.76 g/mol
Exact Mass299.08
IUPAC Name6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
SMILESC=Cc1cc2c(cc1Cl)N(C(=O)Nc1cccnc1)CC2
InChIInChI=1S/C16H14ClN3O/c1-2-11-8-12-5-7-20(15(12)9-14(11)17)16(21)19-13-4-3-6-18-10-13/h2-4,6,8-10H,1,5,7H2,(H,19,21)
InChIKeyILEVMOFZKXQODL-UHFFFAOYSA-N
XLogP3.97
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.76
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-iodo-5-methyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
CID 10595858
4,6-dichloro-5-methyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
CID 10567817
5-propylsulfanyl-N-pyridin-3-yl-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide
CID 10714852
N-pyridin-3-yl-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 166316460
2-[(3,5-dichlorophenyl)sulfanyl-[1-(pyridin-3-ylcarbamoyl)-2,3-dihydroindol-5-yl]amino]acetic acid
CID 88860037
1-(1-acetyl-2,3-dihydroindol-5-yl)-3-pyridin-3-ylurea
CID 18101699
2,3-dimethyl-N-pyridin-3-yl-7,8-dihydropyrrolo[3,2-e]indole-6-carboxamide
CID 54564636
1-(1-methyl-2,3-dihydroindol-5-yl)-3-pyridin-3-ylurea;hydrochloride
CID 11957462
4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 3370606
4-(bromomethylidene)-N-pyridin-3-ylpiperidine-1-carboxamide
CID 66883942
4-formyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 110706402
2-amino-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]acetamide
CID 22689805

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide (CID 18940889) is 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide is C=Cc1cc2c(cc1Cl)N(C(=O)Nc1cccnc1)CC2.
What is the InChIKey of 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
The InChIKey is ILEVMOFZKXQODL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O/c1-2-11-8-12-5-7-20(15(12)9-14(11)17)16(21)19-13-4-3-6-18-10-13/h2-4,6,8-10H,1,5,7H2,(H,19,21).
What are the key properties of 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide?
6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide has a molecular weight of 299.76 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-ethenyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 18940889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).