3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide

C15H22N2O2 — CID 55164039

IUPAC3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide
SMILESCNc1ccc(C(=O)NCCC2CCCO2)cc1C
InChIInChI=1S/C15H22N2O2/c1-11-10-12(5-6-14(11)16-2)15(18)17-8-7-13-4-3-9-19-13/h5-6,10,13,16H,3-4,7-9H2,1-2H3,(H,17,18)
InChIKeyFKRUSEVRVZKHFU-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.34
Rot. Bonds5

About 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide

3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide (PubChem CID 55164039) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide
PubChem CID55164039
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide
SMILESCNc1ccc(C(=O)NCCC2CCCO2)cc1C
InChIInChI=1S/C15H22N2O2/c1-11-10-12(5-6-14(11)16-2)15(18)17-8-7-13-4-3-9-19-13/h5-6,10,13,16H,3-4,7-9H2,1-2H3,(H,17,18)
InChIKeyFKRUSEVRVZKHFU-UHFFFAOYSA-N
XLogP2.34
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 54915859
methyl 3-[2-(oxolan-2-yl)ethylcarbamoyl]benzoate
CID 51086480
3-amino-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 54915842
3-methyl-4-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 114516650
3-acetamido-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 110745062
3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 94022695
4-methyl-N-[2-[2-(oxolan-2-yl)ethylamino]ethyl]benzamide
CID 65163508
4-hydrazinyl-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 62249331
4-[2-(oxan-2-yl)ethylcarbamoyl]benzoic acid
CID 106704122
3,4-dimethyl-N-[3-(oxolan-2-ylmethoxy)propyl]benzamide
CID 134000506
N-[2-(oxolan-2-yl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 54917511
2-chloro-5-[2-(oxolan-2-yl)ethylcarbamoyl]benzenesulfonyl chloride
CID 65370822

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide?
The IUPAC name of 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide (CID 55164039) is 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide.
What is the SMILES notation for 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide?
The canonical SMILES for 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide is CNc1ccc(C(=O)NCCC2CCCO2)cc1C.
What is the InChIKey of 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide?
The InChIKey is FKRUSEVRVZKHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-10-12(5-6-14(11)16-2)15(18)17-8-7-13-4-3-9-19-13/h5-6,10,13,16H,3-4,7-9H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide?
3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide has a molecular weight of 262.35 g/mol, XLogP of 2.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide is sourced from PubChem (CID 55164039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).