N-[(2-methoxyphenyl)methyl]-N-methylpropanamide

C12H17NO2 — CID 60630949

IUPACN-[(2-methoxyphenyl)methyl]-N-methylpropanamide
SMILESCCC(=O)N(C)Cc1ccccc1OC
InChIInChI=1S/C12H17NO2/c1-4-12(14)13(2)9-10-7-5-6-8-11(10)15-3/h5-8H,4,9H2,1-3H3
InChIKeyYNIMNFHAMMOHAO-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.06
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-N-methylpropanamide

N-[(2-methoxyphenyl)methyl]-N-methylpropanamide (PubChem CID 60630949) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N-methylpropanamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N-methylpropanamide
PubChem CID60630949
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-[(2-methoxyphenyl)methyl]-N-methylpropanamide
SMILESCCC(=O)N(C)Cc1ccccc1OC
InChIInChI=1S/C12H17NO2/c1-4-12(14)13(2)9-10-7-5-6-8-11(10)15-3/h5-8H,4,9H2,1-3H3
InChIKeyYNIMNFHAMMOHAO-UHFFFAOYSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 60718962
3-[(2-methoxyphenyl)methyl-methylamino]-3-oxopropanoic acid
CID 62232246
3-cyano-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 94685610
1,1-diethyl-3-[(2-methoxyphenyl)methyl]-3-methylurea
CID 113233571
3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N-methylbutanamide
CID 55121106
3-[[2-[(2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-methylamino]propanoic acid
CID 119911597
7-amino-N-[(2-methoxyphenyl)methyl]-N-methylheptanamide
CID 61027379
2,2,2-trifluoro-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 62735211
3-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 94870765
2-(azetidin-3-yl)-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 64610785
N-[(2-methoxyphenyl)methyl]-N-methyl-3-phenylsulfanylpropanamide
CID 46778454
2,6-dihydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 103748911

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N-methylpropanamide (CID 60630949) is N-[(2-methoxyphenyl)methyl]-N-methylpropanamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N-methylpropanamide is CCC(=O)N(C)Cc1ccccc1OC.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
The InChIKey is YNIMNFHAMMOHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-4-12(14)13(2)9-10-7-5-6-8-11(10)15-3/h5-8H,4,9H2,1-3H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
N-[(2-methoxyphenyl)methyl]-N-methylpropanamide has a molecular weight of 207.27 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N-methylpropanamide is sourced from PubChem (CID 60630949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).