N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide

C15H24N2O — CID 115165838

IUPACN,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide
SMILESCNC(C)(C)C(=O)N(C)CCc1cccc(C)c1
InChIInChI=1S/C15H24N2O/c1-12-7-6-8-13(11-12)9-10-17(5)14(18)15(2,3)16-4/h6-8,11,16H,9-10H2,1-5H3
InChIKeyGNDHKACGPMSOFP-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.99
Rot. Bonds5

About N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide

N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide (PubChem CID 115165838) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide
PubChem CID115165838
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide
SMILESCNC(C)(C)C(=O)N(C)CCc1cccc(C)c1
InChIInChI=1S/C15H24N2O/c1-12-7-6-8-13(11-12)9-10-17(5)14(18)15(2,3)16-4/h6-8,11,16H,9-10H2,1-5H3
InChIKeyGNDHKACGPMSOFP-UHFFFAOYSA-N
XLogP1.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-2-(methylamino)-N-(2-phenylethyl)propanamide
CID 62846352
2-[methyl-[2-(3-methylphenyl)ethyl]amino]-2-oxoacetic acid
CID 82127746
N,2-dimethyl-2-(methylamino)-N-(2-pyridin-4-ylethyl)propanamide
CID 62847427
N-methyl-N-[2-(3-methylphenyl)ethyl]-2-oxoacetamide
CID 115166756
N-[2-(4-chlorophenyl)ethyl]-N,2-dimethyl-2-(methylamino)propanamide
CID 115165826
2-(ethylamino)-N-methyl-N-[2-(3-methylphenyl)ethyl]acetamide
CID 115158122
2-methyl-2-(methylamino)-N-[(3-methylphenyl)methyl]propanamide
CID 62847250
2-methyl-3-[methyl-[2-(3-methylphenyl)ethyl]amino]-3-oxopropanoic acid
CID 115164386
2,2-dimethyl-3-[methyl-[2-(3-methylphenyl)ethyl]amino]propanoic acid
CID 115136684
N-methyl-N-[2-(3-methylphenyl)ethyl]pentanamide
CID 23577992
2-amino-3-[methyl-[2-(3-methylphenyl)ethyl]amino]-3-oxopropanoic acid
CID 115179509
N-benzyl-N,2-dimethyl-2-(methylamino)propanamide
CID 62834859

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide?
The IUPAC name of N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide (CID 115165838) is N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide.
What is the SMILES notation for N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide?
The canonical SMILES for N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide is CNC(C)(C)C(=O)N(C)CCc1cccc(C)c1.
What is the InChIKey of N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide?
The InChIKey is GNDHKACGPMSOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-7-6-8-13(11-12)9-10-17(5)14(18)15(2,3)16-4/h6-8,11,16H,9-10H2,1-5H3.
What are the key properties of N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide?
N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide has a molecular weight of 248.37 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-2-(methylamino)-N-[2-(3-methylphenyl)ethyl]propanamide is sourced from PubChem (CID 115165838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).