N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide

C15H21N3O2 — CID 76893982

IUPACN-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide
SMILESCCCN(CC(=O)NC)C(=O)C1Cc2ccccc2N1
InChIInChI=1S/C15H21N3O2/c1-3-8-18(10-14(19)16-2)15(20)13-9-11-6-4-5-7-12(11)17-13/h4-7,13,17H,3,8-10H2,1-2H3,(H,16,19)
InChIKeyZMKXADIOWXHLEZ-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.01
Rot. Bonds5

About N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide

N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76893982) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76893982
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide
SMILESCCCN(CC(=O)NC)C(=O)C1Cc2ccccc2N1
InChIInChI=1S/C15H21N3O2/c1-3-8-18(10-14(19)16-2)15(20)13-9-11-6-4-5-7-12(11)17-13/h4-7,13,17H,3,8-10H2,1-2H3,(H,16,19)
InChIKeyZMKXADIOWXHLEZ-UHFFFAOYSA-N
XLogP1.01
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76894026
N-butyl-N-ethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76892094
N-cyclopropyl-N-propyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76893036
(2S)-N-ethyl-N-(2-hydroxyethyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61165256
(2S)-N,N-bis(2-hydroxyethyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61163081
N-ethyl-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 76893209
N-ethyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76892548
(2S)-N-butyl-N-methyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61148251
N-ethyl-N-(2-methylbutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 80567400
N,N-dimethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 18184482
(2S)-N-ethyl-N-(2-ethylbutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61156300
(2S)-N-cyclopropyl-N-ethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61155358

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide (CID 76893982) is N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide is CCCN(CC(=O)NC)C(=O)C1Cc2ccccc2N1.
What is the InChIKey of N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is ZMKXADIOWXHLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-3-8-18(10-14(19)16-2)15(20)13-9-11-6-4-5-7-12(11)17-13/h4-7,13,17H,3,8-10H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide?
N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)-2-oxoethyl]-N-propyl-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76893982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).