2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide

C15H21N3O — CID 119331183

IUPAC2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide
SMILESCCCn1ccc2ccc(NC(=O)C(C)(C)N)cc21
InChIInChI=1S/C15H21N3O/c1-4-8-18-9-7-11-5-6-12(10-13(11)18)17-14(19)15(2,3)16/h5-7,9-10H,4,8,16H2,1-3H3,(H,17,19)
InChIKeyTWDHPPKPTHZNDX-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.73
Rot. Bonds4

About 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide

2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide (PubChem CID 119331183) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide
PubChem CID119331183
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide
SMILESCCCn1ccc2ccc(NC(=O)C(C)(C)N)cc21
InChIInChI=1S/C15H21N3O/c1-4-8-18-9-7-11-5-6-12(10-13(11)18)17-14(19)15(2,3)16/h5-7,9-10H,4,8,16H2,1-3H3,(H,17,19)
InChIKeyTWDHPPKPTHZNDX-UHFFFAOYSA-N
XLogP2.73
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-methylpropanamide
CID 119891239
2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride
CID 119331199
2-methyl-3-(methylamino)-N-(1-propylindol-6-yl)propanamide;hydrochloride
CID 119797080
3-methylsulfonyl-N-(1-propylindol-6-yl)propanamide
CID 71990600
4-amino-3-methoxy-N-(1-propylindol-6-yl)butanamide
CID 120592934
2-amino-4-methylsulfonyl-N-(1-propylindol-6-yl)butanamide
CID 119957554
3-amino-N-(1-propylindol-6-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 119797067
1-(4-hydroxy-2-methylbutyl)-3-(1-propylindol-6-yl)urea
CID 111474973
2-(4-methyl-1,4-diazepan-1-yl)-2-oxo-N-(1-propylindol-6-yl)acetamide
CID 99715807
1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea
CID 111474971
(3S)-3-methylsulfonyl-N-(1-propylindol-6-yl)pyrrolidine-1-carboxamide
CID 125141718
3-(hydroxymethyl)-N-(1-propylindol-6-yl)piperidine-1-carboxamide
CID 111474969

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide?
The IUPAC name of 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide (CID 119331183) is 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide?
The canonical SMILES for 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide is CCCn1ccc2ccc(NC(=O)C(C)(C)N)cc21.
What is the InChIKey of 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide?
The InChIKey is TWDHPPKPTHZNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-4-8-18-9-7-11-5-6-12(10-13(11)18)17-14(19)15(2,3)16/h5-7,9-10H,4,8,16H2,1-3H3,(H,17,19).
What are the key properties of 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide?
2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide has a molecular weight of 259.35 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide is sourced from PubChem (CID 119331183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).