4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide

C15H22N2O2 — CID 62175319

IUPAC4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide
SMILESCCNc1ccc(C(=O)NCC2CCCOC2)cc1
InChIInChI=1S/C15H22N2O2/c1-2-16-14-7-5-13(6-8-14)15(18)17-10-12-4-3-9-19-11-12/h5-8,12,16H,2-4,9-11H2,1H3,(H,17,18)
InChIKeyCTRHVTGEZAUNCA-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.27
Rot. Bonds5

About 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide

4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide (PubChem CID 62175319) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide
PubChem CID62175319
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide
SMILESCCNc1ccc(C(=O)NCC2CCCOC2)cc1
InChIInChI=1S/C15H22N2O2/c1-2-16-14-7-5-13(6-8-14)15(18)17-10-12-4-3-9-19-11-12/h5-8,12,16H,2-4,9-11H2,1H3,(H,17,18)
InChIKeyCTRHVTGEZAUNCA-UHFFFAOYSA-N
XLogP2.27
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 ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydrazinyl-N-(oxan-3-ylmethyl)benzamide
CID 62247297
N-(cyclopropylmethyl)-4-(ethylamino)benzamide
CID 62173113
4-[ethyl(methyl)amino]-N-(oxan-3-ylmethyl)benzamide
CID 47447689
N-ethyl-2-[4-(oxan-3-ylmethylamino)phenyl]acetamide
CID 63741623
N-cyclopropyl-4-(oxan-3-ylmethylamino)benzamide
CID 63737546
4-(2-methylsulfanylphenyl)-N-[[(3S)-oxan-3-yl]methyl]benzamide
CID 126439334
3-bromo-4-methyl-N-(oxan-3-ylmethyl)benzamide
CID 79466570
4-(ethylamino)-N-[(3-methylcyclopentyl)methyl]benzamide
CID 107415191
N-(oxan-3-ylmethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47292432
N-(cyclobutylmethyl)-4-(propylamino)benzamide
CID 62170357
N-[[(3R)-oxan-3-yl]methyl]-3-(propan-2-ylamino)benzamide
CID 99806943
3-hydroxy-4-methoxy-N-(oxan-3-ylmethyl)benzamide
CID 79672650

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide?
The IUPAC name of 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide (CID 62175319) is 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide.
What is the SMILES notation for 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide?
The canonical SMILES for 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide is CCNc1ccc(C(=O)NCC2CCCOC2)cc1.
What is the InChIKey of 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide?
The InChIKey is CTRHVTGEZAUNCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-16-14-7-5-13(6-8-14)15(18)17-10-12-4-3-9-19-11-12/h5-8,12,16H,2-4,9-11H2,1H3,(H,17,18).
What are the key properties of 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide?
4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide has a molecular weight of 262.35 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide is sourced from PubChem (CID 62175319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).