2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide

C14H20N2O2 — CID 80714846

IUPAC2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide
SMILESCCNc1cc(C)ccc1C(=O)NC1CCOC1
InChIInChI=1S/C14H20N2O2/c1-3-15-13-8-10(2)4-5-12(13)14(17)16-11-6-7-18-9-11/h4-5,8,11,15H,3,6-7,9H2,1-2H3,(H,16,17)
InChIKeyKVYRYGQSNWLRHV-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.95
Rot. Bonds4

About 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide

2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide (PubChem CID 80714846) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide
PubChem CID80714846
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide
SMILESCCNc1cc(C)ccc1C(=O)NC1CCOC1
InChIInChI=1S/C14H20N2O2/c1-3-15-13-8-10(2)4-5-12(13)14(17)16-11-6-7-18-9-11/h4-5,8,11,15H,3,6-7,9H2,1-2H3,(H,16,17)
InChIKeyKVYRYGQSNWLRHV-UHFFFAOYSA-N
XLogP1.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-5-methyl-N-(oxolan-3-yl)benzamide
CID 80712573
2,4-dimethyl-N-(oxan-4-yl)benzamide
CID 70845723
2-(ethylamino)-4-methyl-N-morpholin-4-ylbenzamide
CID 83024771
2-(ethylamino)-6-methyl-N-(oxolan-3-yl)pyridine-4-carboxamide
CID 113379136
2-(3-aminoprop-1-ynyl)-5-methyl-N-(oxolan-3-yl)benzamide
CID 81111848
3-(ethylamino)-4-nitro-N-(oxolan-3-yl)benzamide
CID 80715844
2-methyl-N-[(3R)-oxolan-3-yl]benzamide
CID 70845923
2-methyl-N-[(3S)-oxolan-3-yl]benzamide
CID 70955221
N-(3-cyclopentylpropyl)-2-(ethylamino)-4-methylbenzamide
CID 106015467
6-chloro-2-methyl-N-(oxolan-3-yl)pyridine-3-carboxamide
CID 168678063
2-(ethylamino)-5-nitro-N-(oxan-4-yl)benzamide
CID 62170102
2-amino-4-chloro-N-(oxolan-3-yl)benzamide
CID 80717146

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide?
The IUPAC name of 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide (CID 80714846) is 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide.
What is the SMILES notation for 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide?
The canonical SMILES for 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide is CCNc1cc(C)ccc1C(=O)NC1CCOC1.
What is the InChIKey of 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide?
The InChIKey is KVYRYGQSNWLRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-15-13-8-10(2)4-5-12(13)14(17)16-11-6-7-18-9-11/h4-5,8,11,15H,3,6-7,9H2,1-2H3,(H,16,17).
What are the key properties of 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide?
2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-methyl-N-(oxolan-3-yl)benzamide is sourced from PubChem (CID 80714846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).