5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide

C15H20N4O2 — CID 103106426

IUPAC5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide
SMILESCCN(C)C(=O)C(C)NC(=O)c1cc2cc(N)ccc2[nH]1
InChIInChI=1S/C15H20N4O2/c1-4-19(3)15(21)9(2)17-14(20)13-8-10-7-11(16)5-6-12(10)18-13/h5-9,18H,4,16H2,1-3H3,(H,17,20)
InChIKeyZXHIWVNTCCLDOW-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.35
Rot. Bonds4

About 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide

5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide (PubChem CID 103106426) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide
PubChem CID103106426
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide
SMILESCCN(C)C(=O)C(C)NC(=O)c1cc2cc(N)ccc2[nH]1
InChIInChI=1S/C15H20N4O2/c1-4-19(3)15(21)9(2)17-14(20)13-8-10-7-11(16)5-6-12(10)18-13/h5-9,18H,4,16H2,1-3H3,(H,17,20)
InChIKeyZXHIWVNTCCLDOW-UHFFFAOYSA-N
XLogP1.35
TPSA91.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide with MolForge

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Related Compounds

5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-1H-indole-2-carboxamide
CID 63117766
5-amino-N-ethyl-N-methyl-1H-indole-2-carboxamide
CID 63117893
5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-3-carboxamide
CID 103106404
5-amino-N-propan-2-yl-1H-indole-2-carboxamide;N,N-dimethyl-2-propan-2-yloxyethanamine
CID 163474124
5-amino-N-(2-methylbutyl)-1H-indole-2-carboxamide
CID 55179457
5-amino-N-methyl-1H-indole-2-carboxamide
CID 63117746
5-amino-N-butan-2-yl-N-ethyl-1H-indole-2-carboxamide
CID 63117753
5-amino-N-(1-thiophen-2-ylpropyl)-1H-indole-2-carboxamide
CID 63118272
5-amino-N-butyl-N-methyl-1H-indole-2-carboxamide
CID 62058452
5-amino-N-ethyl-N-[2-(methylamino)-2-oxoethyl]-1H-indole-2-carboxamide
CID 63117755
5-amino-N-(1-pyridin-2-ylethyl)-1H-indole-2-carboxamide
CID 63117840
1-(5-amino-1H-indol-2-yl)ethanone
CID 59837588

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide?
The IUPAC name of 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide (CID 103106426) is 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide?
The canonical SMILES for 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide is CCN(C)C(=O)C(C)NC(=O)c1cc2cc(N)ccc2[nH]1.
What is the InChIKey of 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide?
The InChIKey is ZXHIWVNTCCLDOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-19(3)15(21)9(2)17-14(20)13-8-10-7-11(16)5-6-12(10)18-13/h5-9,18H,4,16H2,1-3H3,(H,17,20).
What are the key properties of 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide?
5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-1H-indole-2-carboxamide is sourced from PubChem (CID 103106426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).