2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide

C18H26N2O — CID 119032237

IUPAC2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide
SMILESCc1ccc(C)c(NC(=O)C(C)NC(C2CC2)C2CC2)c1
InChIInChI=1S/C18H26N2O/c1-11-4-5-12(2)16(10-11)20-18(21)13(3)19-17(14-6-7-14)15-8-9-15/h4-5,10,13-15,17,19H,6-9H2,1-3H3,(H,20,21)
InChIKeyNWPOJERCGBUFMJ-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.41
Rot. Bonds6

About 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide

2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide (PubChem CID 119032237) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide.

Molecular Properties

Compound Name2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide
PubChem CID119032237
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide
SMILESCc1ccc(C)c(NC(=O)C(C)NC(C2CC2)C2CC2)c1
InChIInChI=1S/C18H26N2O/c1-11-4-5-12(2)16(10-11)20-18(21)13(3)19-17(14-6-7-14)15-8-9-15/h4-5,10,13-15,17,19H,6-9H2,1-3H3,(H,20,21)
InChIKeyNWPOJERCGBUFMJ-UHFFFAOYSA-N
XLogP3.41
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(dicyclopropylmethylamino)-N-(4-methylphenyl)propanamide
CID 60714008
2-chloro-N-(2,5-dimethylphenyl)propanamide
CID 25218955
(2S)-N-(2,5-dimethylphenyl)-2-methylsulfonylpropanamide
CID 94024925
2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide
CID 120782547
2-bromo-N-(2,5-dimethylphenyl)-3-methylbutanamide
CID 24710246
2-(2,3-dimethylanilino)-N-(2,5-dimethylphenyl)propanamide
CID 46757405
N-(2,5-dimethylphenyl)-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide
CID 110020032
1-[(2S)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl]piperidin-1-ium-4-carboxamide
CID 9443498
(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
CID 28827851
N-(2,5-dimethylphenyl)-2-[4-(hydroxymethyl)piperidin-1-yl]propanamide
CID 110891637
2-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide
CID 24690389
(2S)-N-(2,5-dimethylphenyl)-2-(2,4-dimethylphenyl)sulfanylpropanamide
CID 8734713

Frequently Asked Questions

What is the IUPAC name of 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide?
The IUPAC name of 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide (CID 119032237) is 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide.
What is the SMILES notation for 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide?
The canonical SMILES for 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide is Cc1ccc(C)c(NC(=O)C(C)NC(C2CC2)C2CC2)c1.
What is the InChIKey of 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide?
The InChIKey is NWPOJERCGBUFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-11-4-5-12(2)16(10-11)20-18(21)13(3)19-17(14-6-7-14)15-8-9-15/h4-5,10,13-15,17,19H,6-9H2,1-3H3,(H,20,21).
What are the key properties of 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide?
2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide has a molecular weight of 286.42 g/mol, XLogP of 3.41, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide is sourced from PubChem (CID 119032237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).