2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide

C12H18N2O2 — CID 81275945

IUPAC2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide
SMILESCNCC(C)Oc1ccc(C(N)=O)c(C)c1
InChIInChI=1S/C12H18N2O2/c1-8-6-10(16-9(2)7-14-3)4-5-11(8)12(13)15/h4-6,9,14H,7H2,1-3H3,(H2,13,15)
InChIKeyNVCLREIPEIRJBB-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.08
Rot. Bonds5

About 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide

2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide (PubChem CID 81275945) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide.

Molecular Properties

Compound Name2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide
PubChem CID81275945
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide
SMILESCNCC(C)Oc1ccc(C(N)=O)c(C)c1
InChIInChI=1S/C12H18N2O2/c1-8-6-10(16-9(2)7-14-3)4-5-11(8)12(13)15/h4-6,9,14H,7H2,1-3H3,(H2,13,15)
InChIKeyNVCLREIPEIRJBB-UHFFFAOYSA-N
XLogP1.08
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide
CID 106486919
1-(4-methoxy-2-methylphenyl)-2-methyl-3-(methylamino)propan-1-one
CID 116586918
2-(3,4-difluorophenoxy)-N-methylpropan-1-amine
CID 62485369
4-(3-chloropropoxy)-2-methylbenzamide
CID 68504171
2-amino-5-(4-methylpentan-2-yloxy)benzamide
CID 55139339
6-chloro-3-[2-(3-methylphenoxy)propylamino]pyridazine-4-carboxamide
CID 133341092
4-(4-carbamoyl-3-methylanilino)-3-methylbutanoic acid
CID 81273308
2-methyl-3-(methylamino)-N-[2-(3-methylphenoxy)propyl]propanamide;hydrochloride
CID 119804933
2-(4-ethylphenoxy)-N-methylpropan-1-amine
CID 54798642
2-(3,4-dimethylphenoxy)propan-1-amine
CID 17169740
4-(hydroxymethyl)-2-methylbenzamide
CID 69484226
4-(2-amino-2-methylbutoxy)-2-methylbenzamide
CID 81276903

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide?
The IUPAC name of 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide (CID 81275945) is 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide.
What is the SMILES notation for 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide?
The canonical SMILES for 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide is CNCC(C)Oc1ccc(C(N)=O)c(C)c1.
What is the InChIKey of 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide?
The InChIKey is NVCLREIPEIRJBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8-6-10(16-9(2)7-14-3)4-5-11(8)12(13)15/h4-6,9,14H,7H2,1-3H3,(H2,13,15).
What are the key properties of 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide?
2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide has a molecular weight of 222.29 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[1-(methylamino)propan-2-yloxy]benzamide is sourced from PubChem (CID 81275945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).