2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide

C15H21N3O — CID 62230821

IUPAC2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide
SMILESCC(CN1Cc2ccccc2C1)(NC1CC1)C(N)=O
InChIInChI=1S/C15H21N3O/c1-15(14(16)19,17-13-6-7-13)10-18-8-11-4-2-3-5-12(11)9-18/h2-5,13,17H,6-10H2,1H3,(H2,16,19)
InChIKeyHFOOOXRUSMOUEN-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.00
Rot. Bonds5

About 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide

2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide (PubChem CID 62230821) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide
PubChem CID62230821
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide
SMILESCC(CN1Cc2ccccc2C1)(NC1CC1)C(N)=O
InChIInChI=1S/C15H21N3O/c1-15(14(16)19,17-13-6-7-13)10-18-8-11-4-2-3-5-12(11)9-18/h2-5,13,17H,6-10H2,1H3,(H2,16,19)
InChIKeyHFOOOXRUSMOUEN-UHFFFAOYSA-N
XLogP1.00
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide 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

2-(cyclopropylamino)-5-(1,3-dihydroisoindol-2-yl)-2-methylpentanamide
CID 62232161
2-(cyclopropylamino)-2-methyl-3-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 63465996
2-(cyclopropylamino)-2-methyl-3-phenylpropanoic acid
CID 114988664
2-[(1-benzylpiperidin-4-yl)amino]-2-methylpropanamide
CID 61211452
2-(cyclopropylamino)-3-[3-(dimethylamino)pyrrolidin-1-yl]-2-methylpropanamide
CID 63165424
2-cyclopropyl-3-(1,3-dihydroisoindol-2-yl)-2-(ethylamino)propanamide
CID 63925390
4-benzylsulfanyl-2-(cyclopropylamino)-2-methylpentanamide
CID 64709096
2-amino-4-(1,3-dihydroisoindol-2-yl)-2-methylbutanamide
CID 62231177
2-(cyclopropylamino)-4-(1,3-dihydroisoindol-2-yl)-2-methylbutan-1-ol
CID 64788187
2-(cyclopropylamino)-2-methyl-4-phenoxypentanamide
CID 64706033
2-(cyclopentylamino)-3-(2-fluorophenyl)-2-methylpropanamide
CID 114831945
2-(cyclopropylamino)-3-(2,6-difluorophenoxy)-2-methylpropanamide
CID 81269914

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide?
The IUPAC name of 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide (CID 62230821) is 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide.
What is the SMILES notation for 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide?
The canonical SMILES for 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide is CC(CN1Cc2ccccc2C1)(NC1CC1)C(N)=O.
What is the InChIKey of 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide?
The InChIKey is HFOOOXRUSMOUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-15(14(16)19,17-13-6-7-13)10-18-8-11-4-2-3-5-12(11)9-18/h2-5,13,17H,6-10H2,1H3,(H2,16,19).
What are the key properties of 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide?
2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide has a molecular weight of 259.35 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)-2-methylpropanamide is sourced from PubChem (CID 62230821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).