N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide

C13H17N3O — CID 115165574

IUPACN-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide
SMILESCNC(C)(C)C(=O)Nc1c[nH]c2ccccc12
InChIInChI=1S/C13H17N3O/c1-13(2,14-3)12(17)16-11-8-15-10-7-5-4-6-9(10)11/h4-8,14-15H,1-3H3,(H,16,17)
InChIKeyWSOMMLDORMLUCH-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.10
Rot. Bonds3

About N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide

N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide (PubChem CID 115165574) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide
PubChem CID115165574
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide
SMILESCNC(C)(C)C(=O)Nc1c[nH]c2ccccc12
InChIInChI=1S/C13H17N3O/c1-13(2,14-3)12(17)16-11-8-15-10-7-5-4-6-9(10)11/h4-8,14-15H,1-3H3,(H,16,17)
InChIKeyWSOMMLDORMLUCH-UHFFFAOYSA-N
XLogP2.10
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1H-indol-3-ylamino)-2,2-dimethyl-3-oxopropanoic acid
CID 115163934
2-cyano-N-(1H-indol-3-yl)-2-methylpropanamide
CID 115174941
1H-indol-3-ylcarbamic acid
CID 66672709
N-methyl-1H-indol-3-amine;oxalic acid
CID 69068496
1-ethyl-3-(1H-indol-3-yl)urea
CID 7615926
N-(1H-indol-3-yl)butanamide;dihydrochloride
CID 142898662
N-(2-chlorophenyl)-2-methyl-2-(methylamino)propanamide
CID 62835426
2-chloro-N-(1H-indol-3-yl)benzamide
CID 56763159
1-[(2R)-2-hydroxypropyl]-3-(1H-indol-3-yl)urea
CID 7615942
methyl 3-(1H-indol-3-ylamino)-2,2-dimethylpropanoate
CID 115233577
2-methyl-2-(methylamino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 62834657
N-(1H-indol-3-yl)-4-methylpiperazine-1-carboxamide
CID 7615909

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide?
The IUPAC name of N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide (CID 115165574) is N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide.
What is the SMILES notation for N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide?
The canonical SMILES for N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide is CNC(C)(C)C(=O)Nc1c[nH]c2ccccc12.
What is the InChIKey of N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide?
The InChIKey is WSOMMLDORMLUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-13(2,14-3)12(17)16-11-8-15-10-7-5-4-6-9(10)11/h4-8,14-15H,1-3H3,(H,16,17).
What are the key properties of N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide?
N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide has a molecular weight of 231.30 g/mol, XLogP of 2.10, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-3-yl)-2-methyl-2-(methylamino)propanamide is sourced from PubChem (CID 115165574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).