5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide

C15H19N3O — CID 55178492

IUPAC5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cc2cc(N)ccc2[nH]1
InChIInChI=1S/C15H19N3O/c1-9(10-3-4-10)18(2)15(19)14-8-11-7-12(16)5-6-13(11)17-14/h5-10,17H,3-4,16H2,1-2H3
InChIKeySDIAUBWQAUZBMO-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.62
Rot. Bonds3

About 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide

5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide (PubChem CID 55178492) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide
PubChem CID55178492
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide
SMILESCC(C1CC1)N(C)C(=O)c1cc2cc(N)ccc2[nH]1
InChIInChI=1S/C15H19N3O/c1-9(10-3-4-10)18(2)15(19)14-8-11-7-12(16)5-6-13(11)17-14/h5-10,17H,3-4,16H2,1-2H3
InChIKeySDIAUBWQAUZBMO-UHFFFAOYSA-N
XLogP2.62
TPSA62.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-amino-N-ethyl-N-methyl-1H-indole-2-carboxamide
CID 63117893
1-(5-amino-1H-indol-2-yl)ethanone
CID 59837588
5-amino-N-butan-2-yl-N-ethyl-1H-indole-2-carboxamide
CID 63117753
5-amino-N-methyl-N-[(2-methylcyclopropyl)methyl]-1H-indole-2-carboxamide
CID 63877695
5-amino-N-methyl-N-(oxan-4-ylmethyl)-1H-indole-2-carboxamide
CID 63727606
5-amino-N-butyl-N-methyl-1H-indole-2-carboxamide
CID 62058452
5-amino-N-cyclopentyl-N-(2-hydroxyethyl)-1H-indole-2-carboxamide
CID 63118382
5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-1H-indole-2-carboxamide
CID 63117766
ethyl 2-[(5-amino-1H-indole-2-carbonyl)-methylamino]acetate
CID 63118284
cyclobutyl 5-amino-1H-indole-2-carboxylate
CID 107363368
cyclopropylmethyl 5-amino-1H-indole-2-carboxylate
CID 107363338
3-methylbutan-2-yl 5-amino-1H-indole-2-carboxylate
CID 107363382

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide?
The IUPAC name of 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide (CID 55178492) is 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide?
The canonical SMILES for 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide is CC(C1CC1)N(C)C(=O)c1cc2cc(N)ccc2[nH]1.
What is the InChIKey of 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide?
The InChIKey is SDIAUBWQAUZBMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-9(10-3-4-10)18(2)15(19)14-8-11-7-12(16)5-6-13(11)17-14/h5-10,17H,3-4,16H2,1-2H3.
What are the key properties of 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide?
5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(1-cyclopropylethyl)-N-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 55178492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).