2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide

C16H24N2O — CID 110481403

IUPAC2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide
SMILESCCC(CC)C(=O)NCc1ccc2c(c1)CCN2C
InChIInChI=1S/C16H24N2O/c1-4-13(5-2)16(19)17-11-12-6-7-15-14(10-12)8-9-18(15)3/h6-7,10,13H,4-5,8-9,11H2,1-3H3,(H,17,19)
InChIKeyZHOLPCWYMQHJQG-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.73
Rot. Bonds5

About 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide

2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide (PubChem CID 110481403) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide
PubChem CID110481403
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide
SMILESCCC(CC)C(=O)NCc1ccc2c(c1)CCN2C
InChIInChI=1S/C16H24N2O/c1-4-13(5-2)16(19)17-11-12-6-7-15-14(10-12)8-9-18(15)3/h6-7,10,13H,4-5,8-9,11H2,1-3H3,(H,17,19)
InChIKeyZHOLPCWYMQHJQG-UHFFFAOYSA-N
XLogP2.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[[1-(4-methylbenzoyl)-2,3-dihydroindol-5-yl]methyl]butanamide
CID 53093637
(2S)-2-amino-4-methyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]pentanamide
CID 110482520
2-ethyl-N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]butanamide
CID 110781420
ethyl N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]carbamate
CID 110479362
N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]-2-phenylacetamide
CID 110483038
2-ethyl-N-(1-methyl-2,3-dihydroindol-5-yl)butanamide
CID 110729318
N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butan-2-amine
CID 62070504
N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]furan-2-carboxamide
CID 110481071
N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]propanamide
CID 51099812
1,1-dimethyl-3-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]urea
CID 110478717
2-[(1-methyl-2,3-dihydroindol-5-yl)methylamino]propanoic acid
CID 62096350
2-N,2-N-dimethyl-1-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]propane-1,2-diamine
CID 55035111

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide?
The IUPAC name of 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide (CID 110481403) is 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide?
The canonical SMILES for 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide is CCC(CC)C(=O)NCc1ccc2c(c1)CCN2C.
What is the InChIKey of 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide?
The InChIKey is ZHOLPCWYMQHJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-13(5-2)16(19)17-11-12-6-7-15-14(10-12)8-9-18(15)3/h6-7,10,13H,4-5,8-9,11H2,1-3H3,(H,17,19).
What are the key properties of 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide?
2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide has a molecular weight of 260.38 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butanamide is sourced from PubChem (CID 110481403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).