7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide

C22H27N3O2 — CID 119761257

IUPAC7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide
SMILESNCCCCCCC(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1
InChIInChI=1S/C22H27N3O2/c23-15-6-2-1-3-9-21(26)24-19-12-10-18(11-13-19)22(27)25-16-14-17-7-4-5-8-20(17)25/h4-5,7-8,10-13H,1-3,6,9,14-16,23H2,(H,24,26)
InChIKeyFIMFRVAVBLZZKW-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.74
Rot. Bonds8

About 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide

7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide (PubChem CID 119761257) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide.

Molecular Properties

Compound Name7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide
PubChem CID119761257
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide
SMILESNCCCCCCC(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1
InChIInChI=1S/C22H27N3O2/c23-15-6-2-1-3-9-21(26)24-19-12-10-18(11-13-19)22(27)25-16-14-17-7-4-5-8-20(17)25/h4-5,7-8,10-13H,1-3,6,9,14-16,23H2,(H,24,26)
InChIKeyFIMFRVAVBLZZKW-UHFFFAOYSA-N
XLogP3.74
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]-4-(methylamino)butanamide
CID 119761261
7-amino-N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]heptanamide
CID 119769035
2-tert-butylsulfanyl-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]acetamide
CID 60608468
ethyl N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]carbamate
CID 17463850
7-amino-N-[4-(4-methylpiperazine-1-carbonyl)phenyl]heptanamide
CID 119861246
N-(4-acetamidophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049557
4-(2,3-dihydroindole-1-carbonyl)-N-(4-fluorophenyl)benzamide
CID 109049539
7-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]heptanamide
CID 119747288
N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119761289
(2S)-2-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]-3,3-dimethylbutanamide
CID 119761273
7-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]heptanamide;hydrochloride
CID 119747287
4-amino-N-[1-(pyridine-2-carbonyl)-2,3-dihydroindol-6-yl]butanamide
CID 22690130

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide?
The IUPAC name of 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide (CID 119761257) is 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide.
What is the SMILES notation for 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide?
The canonical SMILES for 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide is NCCCCCCC(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1.
What is the InChIKey of 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide?
The InChIKey is FIMFRVAVBLZZKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c23-15-6-2-1-3-9-21(26)24-19-12-10-18(11-13-19)22(27)25-16-14-17-7-4-5-8-20(17)25/h4-5,7-8,10-13H,1-3,6,9,14-16,23H2,(H,24,26).
What are the key properties of 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide?
7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide has a molecular weight of 365.48 g/mol, XLogP of 3.74, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]heptanamide is sourced from PubChem (CID 119761257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).