N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide

C22H27N3O2 — CID 7276879

IUPACN-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1cc2cc(Oc3ccccc3)ccc2n1C
InChIInChI=1S/C22H27N3O2/c1-4-25(5-2)14-13-23-22(26)21-16-17-15-19(11-12-20(17)24(21)3)27-18-9-7-6-8-10-18/h6-12,15-16H,4-5,13-14H2,1-3H3,(H,23,26)
InChIKeyULBLBPQEYXQAFH-UHFFFAOYSA-N
MW365.48 g/mol
LogP4.04
Rot. Bonds8

About N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide

N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide (PubChem CID 7276879) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide
PubChem CID7276879
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1cc2cc(Oc3ccccc3)ccc2n1C
InChIInChI=1S/C22H27N3O2/c1-4-25(5-2)14-13-23-22(26)21-16-17-15-19(11-12-20(17)24(21)3)27-18-9-7-6-8-10-18/h6-12,15-16H,4-5,13-14H2,1-3H3,(H,23,26)
InChIKeyULBLBPQEYXQAFH-UHFFFAOYSA-N
XLogP4.04
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-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

N-[2-(4-chlorophenyl)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide
CID 3321068
N-[2-(diethylamino)ethyl]-3-phenoxybenzamide
CID 12941795
dimethyl-[2-[[1-methyl-5-(3-methylphenoxy)indole-2-carbonyl]amino]ethyl]azanium
CID 7346149
N-[2-(diethylamino)ethyl]-4-[2-oxo-3-(4-phenoxyphenyl)imidazolidin-1-yl]benzamide
CID 91185909
N-[2-(diethylamino)ethyl]-2-methoxy-4-[(4-phenoxyphenyl)methyl]benzamide
CID 58730741
N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-methylindole-2-carboxamide
CID 29130862
N-[3-(dimethylamino)propyl]-1-methylindole-2-carboxamide
CID 110468895
5-methoxy-1-methyl-N-phenylindole-2-carboxamide
CID 10707870
N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-(3-methylphenoxy)indole-2-carboxamide
CID 51362396
N-butyl-1,5-dimethylindole-2-carboxamide
CID 7329072
N-[2-(diethylamino)ethyl]-5-methyl-2-phenylpyrazole-3-carboxamide
CID 20861285
N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide
CID 45147924

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide (CID 7276879) is N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide is CCN(CC)CCNC(=O)c1cc2cc(Oc3ccccc3)ccc2n1C.
What is the InChIKey of N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide?
The InChIKey is ULBLBPQEYXQAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-4-25(5-2)14-13-23-22(26)21-16-17-15-19(11-12-20(17)24(21)3)27-18-9-7-6-8-10-18/h6-12,15-16H,4-5,13-14H2,1-3H3,(H,23,26).
What are the key properties of N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide?
N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 4.04, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide is sourced from PubChem (CID 7276879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).