N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride

C16H24ClN2O3- — CID 53352023

IUPACN-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride
SMILESCCCOc1ccc(C(=O)NCCN2CCOCC2)cc1.[Cl-]
InChIInChI=1S/C16H24N2O3.ClH/c1-2-11-21-15-5-3-14(4-6-15)16(19)17-7-8-18-9-12-20-13-10-18;/h3-6H,2,7-13H2,1H3,(H,17,19);1H/p-1
InChIKeyCTIUFCMSXDHYLY-UHFFFAOYSA-M
MW327.83 g/mol
LogP-1.46
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride

N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride (PubChem CID 53352023) has the molecular formula C16H24ClN2O3- and a molecular weight of 327.83 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride
PubChem CID53352023
Molecular FormulaC16H24ClN2O3-
Molecular Weight327.83 g/mol
Exact Mass327.15
IUPAC NameN-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride
SMILESCCCOc1ccc(C(=O)NCCN2CCOCC2)cc1.[Cl-]
InChIInChI=1S/C16H24N2O3.ClH/c1-2-11-21-15-5-3-14(4-6-15)16(19)17-7-8-18-9-12-20-13-10-18;/h3-6H,2,7-13H2,1H3,(H,17,19);1H/p-1
InChIKeyCTIUFCMSXDHYLY-UHFFFAOYSA-M
XLogP-1.46
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.83
LogP ≤ 5-1.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-butoxy-N-[2-(4-morpholin-4-ylbutylamino)-2-oxoethyl]benzamide
CID 55848187
N-(2-morpholin-4-ylethyl)-4-prop-2-ynoxybenzamide
CID 6471547
N-(2-morpholin-4-ylethyl)-4-propan-2-yloxybenzamide
CID 6471257
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
4-butoxy-3-methoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 51159452
4-(ethylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 62166054
N-(2-morpholin-4-ylethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 47039155
5-[(4-butoxybenzoyl)amino]-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-ylbenzamide
CID 4039742
4-ethoxy-N-(2-piperidin-1-ylethyl)benzamide
CID 25237098
4-N-tert-butyl-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045886
4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide
CID 19363436
1-[4-(2-morpholin-4-ylethoxy)phenyl]butan-1-one
CID 66821978

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride?
The IUPAC name of N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride (CID 53352023) is N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride is CCCOc1ccc(C(=O)NCCN2CCOCC2)cc1.[Cl-].
What is the InChIKey of N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride?
The InChIKey is CTIUFCMSXDHYLY-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H24N2O3.ClH/c1-2-11-21-15-5-3-14(4-6-15)16(19)17-7-8-18-9-12-20-13-10-18;/h3-6H,2,7-13H2,1H3,(H,17,19);1H/p-1.
What are the key properties of N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride?
N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride has a molecular weight of 327.83 g/mol, XLogP of -1.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-4-propoxybenzamide chloride is sourced from PubChem (CID 53352023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).