N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide

C14H17N3O2 — CID 102711574

IUPACN-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
SMILESNCC(NC(=O)c1ccc2c(c1)NC(=O)C2)C1CC1
InChIInChI=1S/C14H17N3O2/c15-7-12(8-1-2-8)17-14(19)10-4-3-9-6-13(18)16-11(9)5-10/h3-5,8,12H,1-2,6-7,15H2,(H,16,18)(H,17,19)
InChIKeyMGECUMLDDVHDIT-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.65
Rot. Bonds4

About N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide

N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide (PubChem CID 102711574) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
PubChem CID102711574
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
SMILESNCC(NC(=O)c1ccc2c(c1)NC(=O)C2)C1CC1
InChIInChI=1S/C14H17N3O2/c15-7-12(8-1-2-8)17-14(19)10-4-3-9-6-13(18)16-11(9)5-10/h3-5,8,12H,1-2,6-7,15H2,(H,16,18)(H,17,19)
InChIKeyMGECUMLDDVHDIT-UHFFFAOYSA-N
XLogP0.65
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
CID 119612892
3-cyclopropyl-3-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]propanoic acid
CID 102710846
N-(2-cyclopropyl-2-hydroxyethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712371
(2R)-4-methyl-2-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]pentanoic acid
CID 102710687
N-(2-amino-1-cyclopropylethyl)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide;hydrochloride
CID 119614087
N-(2-amino-1-cyclopropylethyl)naphthalene-2-carboxamide
CID 65189109
N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102711439
N-heptan-2-yl-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102711809
3-hydroxy-2-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]butanoic acid
CID 102710593
N-(2-amino-1-cyclohexylethyl)-2,3-dihydro-1H-indene-5-carboxamide;hydrochloride
CID 119591970
(2S)-3-methyl-2-[(2-oxo-1,3-dihydroindole-6-carbonyl)amino]pentanoic acid
CID 102710671
N-(2-amino-1-cyclopropylethyl)-4-bromo-3-fluorobenzamide
CID 65188732

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide (CID 102711574) is N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide is NCC(NC(=O)c1ccc2c(c1)NC(=O)C2)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The InChIKey is MGECUMLDDVHDIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c15-7-12(8-1-2-8)17-14(19)10-4-3-9-6-13(18)16-11(9)5-10/h3-5,8,12H,1-2,6-7,15H2,(H,16,18)(H,17,19).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide is sourced from PubChem (CID 102711574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).