1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide

C18H25N3O2 — CID 20876883

IUPAC1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide
SMILESCCN1CCCC1CNC(=O)C1Cc2ccccc2N1C(C)=O
InChIInChI=1S/C18H25N3O2/c1-3-20-10-6-8-15(20)12-19-18(23)17-11-14-7-4-5-9-16(14)21(17)13(2)22/h4-5,7,9,15,17H,3,6,8,10-12H2,1-2H3,(H,19,23)
InChIKeyWIVPJHXKPCBNQP-UHFFFAOYSA-N
MW315.42 g/mol
LogP1.56
Rot. Bonds4

About 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide

1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide (PubChem CID 20876883) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide
PubChem CID20876883
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide
SMILESCCN1CCCC1CNC(=O)C1Cc2ccccc2N1C(C)=O
InChIInChI=1S/C18H25N3O2/c1-3-20-10-6-8-15(20)12-19-18(23)17-11-14-7-4-5-9-16(14)21(17)13(2)22/h4-5,7,9,15,17H,3,6,8,10-12H2,1-2H3,(H,19,23)
InChIKeyWIVPJHXKPCBNQP-UHFFFAOYSA-N
XLogP1.56
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-[(1-ethylpyrrolidin-2-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 104896090
(2S)-1-acetyl-N-[(4-ethylphenyl)methyl]-2,3-dihydroindole-2-carboxamide
CID 92710280
N-[(1-ethylpyrrolidin-2-yl)methyl]-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 24702827
(2R)-1-acetyl-N-methyl-2,3-dihydroindole-2-carboxamide
CID 40805370
1-acetyl-N-[2-(dimethylamino)ethyl]-2,3-dihydroindole-2-carboxamide
CID 53299064
1-acetyl-N-[3-(4-methylpiperazin-1-yl)propyl]-2,3-dihydroindole-2-carboxamide
CID 20954390
(2S)-1-acetyl-N-cyclopropyl-N-ethyl-2,3-dihydroindole-2-carboxamide
CID 136580381
1-acetyl-N-[2-(2-methylphenyl)ethyl]-2,3-dihydroindole-2-carboxamide
CID 20954431
1-[2-(4-ethylpiperazine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 20954290
1-acetyl-N-(4-ethylphenyl)-2,3-dihydroindole-2-carboxamide
CID 20954321
N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide;methane
CID 159182126
1-benzyl-3-[(1-ethylpyrrolidin-2-yl)methyl]urea
CID 103604163

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide?
The IUPAC name of 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide (CID 20876883) is 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide.
What is the SMILES notation for 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide?
The canonical SMILES for 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide is CCN1CCCC1CNC(=O)C1Cc2ccccc2N1C(C)=O.
What is the InChIKey of 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide?
The InChIKey is WIVPJHXKPCBNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-3-20-10-6-8-15(20)12-19-18(23)17-11-14-7-4-5-9-16(14)21(17)13(2)22/h4-5,7,9,15,17H,3,6,8,10-12H2,1-2H3,(H,19,23).
What are the key properties of 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide?
1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroindole-2-carboxamide is sourced from PubChem (CID 20876883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).