N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide

C22H24N2O2 — CID 109136782

IUPACN-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)C1CC1C(=O)N1CCc2ccccc21
InChIInChI=1S/C22H24N2O2/c1-2-23(15-16-8-4-3-5-9-16)21(25)18-14-19(18)22(26)24-13-12-17-10-6-7-11-20(17)24/h3-11,18-19H,2,12-15H2,1H3
InChIKeyCXBYHOSUFIBBGZ-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.26
Rot. Bonds5

About N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide

N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide (PubChem CID 109136782) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide
PubChem CID109136782
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)C1CC1C(=O)N1CCc2ccccc21
InChIInChI=1S/C22H24N2O2/c1-2-23(15-16-8-4-3-5-9-16)21(25)18-14-19(18)22(26)24-13-12-17-10-6-7-11-20(17)24/h3-11,18-19H,2,12-15H2,1H3
InChIKeyCXBYHOSUFIBBGZ-UHFFFAOYSA-N
XLogP3.26
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-(2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxylic acid
CID 7101559
N-benzyl-N-ethyl-2-(4-phenylpiperazine-1-carbonyl)cyclopropane-1-carboxamide
CID 109136754
cis-(1R,2S)-2-(2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxylate
CID 7101560
N,N-diethyl-2,3-dihydroindole-1-carboxamide
CID 2987329
N-[4-(diethylamino)phenyl]-2-(2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109141370
[2-[benzyl(ethyl)amino]pyrimidin-5-yl]-(2,3-dihydroindol-1-yl)methanone
CID 109258457
N,N-diethyl-2-(2-methyl-2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109139390
N-benzyl-N-prop-2-enyl-2,3-dihydroindole-1-carboxamide
CID 112824415
N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide
CID 108991209
1-N-benzyl-1-N-ethyl-2-N-(3-phenylpropyl)cyclopropane-1,2-dicarboxamide
CID 109136764
(2S,4S)-4-amino-1-[2-(2,3-dihydroindol-1-yl)-2-oxoacetyl]-N,N-diethylpyrrolidine-2-carboxamide
CID 56719551
2-(2,3-dihydroindole-1-carbonyl)-N-(pyridin-3-ylmethyl)cyclopropane-1-carboxamide
CID 109137070

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide?
The IUPAC name of N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide (CID 109136782) is N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide?
The canonical SMILES for N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide is CCN(Cc1ccccc1)C(=O)C1CC1C(=O)N1CCc2ccccc21.
What is the InChIKey of N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide?
The InChIKey is CXBYHOSUFIBBGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-2-23(15-16-8-4-3-5-9-16)21(25)18-14-19(18)22(26)24-13-12-17-10-6-7-11-20(17)24/h3-11,18-19H,2,12-15H2,1H3.
What are the key properties of N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide?
N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide has a molecular weight of 348.45 g/mol, XLogP of 3.26, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2,3-dihydroindole-1-carbonyl)-N-ethylcyclopropane-1-carboxamide is sourced from PubChem (CID 109136782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).