1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide

C12H12ClN3O2 — CID 65464008

IUPAC1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide
SMILESNC1(C(=O)Nc2cc3c(cc2Cl)NC(=O)C3)CC1
InChIInChI=1S/C12H12ClN3O2/c13-7-5-8-6(4-10(17)15-8)3-9(7)16-11(18)12(14)1-2-12/h3,5H,1-2,4,14H2,(H,15,17)(H,16,18)
InChIKeyZPAXMYZXJVLOGW-UHFFFAOYSA-N
MW265.70 g/mol
LogP1.26
Rot. Bonds2

About 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide

1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide (PubChem CID 65464008) has the molecular formula C12H12ClN3O2 and a molecular weight of 265.70 g/mol. Its IUPAC name is 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide
PubChem CID65464008
Molecular FormulaC12H12ClN3O2
Molecular Weight265.70 g/mol
Exact Mass265.06
IUPAC Name1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide
SMILESNC1(C(=O)Nc2cc3c(cc2Cl)NC(=O)C3)CC1
InChIInChI=1S/C12H12ClN3O2/c13-7-5-8-6(4-10(17)15-8)3-9(7)16-11(18)12(14)1-2-12/h3,5H,1-2,4,14H2,(H,15,17)(H,16,18)
InChIKeyZPAXMYZXJVLOGW-UHFFFAOYSA-N
XLogP1.26
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)butanediamide
CID 60848687
N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-hydroxypentanamide
CID 79200976
4-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-2-methylbutanamide
CID 80543293
2-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-methylpentanamide
CID 43704875
N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 61273589
4-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)oxolane-3-carboxamide
CID 66240426
3-(tert-butylamino)-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 60849399
2-(azetidin-3-yl)-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 116675395
2-chloro-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)furan-3-carboxamide
CID 106685945
methyl 2-[(6-chloro-2-oxo-1,3-dihydroindol-5-yl)amino]butanoate
CID 115352612
1-amino-N-(2,4,5-trichlorophenyl)cyclohexane-1-carboxamide
CID 29300214
1-amino-N-(2,4,5-trichlorophenyl)cyclobutane-1-carboxamide
CID 81167511

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide (CID 65464008) is 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide is NC1(C(=O)Nc2cc3c(cc2Cl)NC(=O)C3)CC1.
What is the InChIKey of 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide?
The InChIKey is ZPAXMYZXJVLOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3O2/c13-7-5-8-6(4-10(17)15-8)3-9(7)16-11(18)12(14)1-2-12/h3,5H,1-2,4,14H2,(H,15,17)(H,16,18).
What are the key properties of 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide?
1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 1.26, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65464008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).