N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide

C24H28N2O5 — CID 25498534

IUPACN-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide
SMILESO=C(NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1OC[C@@H]1CCCO1
InChIInChI=1S/C24H28N2O5/c27-23(21-5-1-2-6-22(21)31-17-20-4-3-13-30-20)25-16-18-7-9-19(10-8-18)24(28)26-11-14-29-15-12-26/h1-2,5-10,20H,3-4,11-17H2,(H,25,27)/t20-/m0/s1
InChIKeyYVLXTDBRINRBRD-FQEVSTJZSA-N
MW424.50 g/mol
LogP2.65
Rot. Bonds7

About N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide

N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide (PubChem CID 25498534) has the molecular formula C24H28N2O5 and a molecular weight of 424.50 g/mol. Its IUPAC name is N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide.

Molecular Properties

Compound NameN-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide
PubChem CID25498534
Molecular FormulaC24H28N2O5
Molecular Weight424.50 g/mol
Exact Mass424.20
IUPAC NameN-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide
SMILESO=C(NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1OC[C@@H]1CCCO1
InChIInChI=1S/C24H28N2O5/c27-23(21-5-1-2-6-22(21)31-17-20-4-3-13-30-20)25-16-18-7-9-19(10-8-18)24(28)26-11-14-29-15-12-26/h1-2,5-10,20H,3-4,11-17H2,(H,25,27)/t20-/m0/s1
InChIKeyYVLXTDBRINRBRD-FQEVSTJZSA-N
XLogP2.65
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[(2R)-oxolan-2-yl]methoxy]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide
CID 41412055
N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 30797106
2-[4-(morpholine-4-carbonyl)anilino]-N-[2-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54831936
2-(oxolan-2-ylmethoxy)-N-prop-2-ynylbenzamide
CID 43047937
N-(3-hydroxypropyl)-2-(oxolan-2-ylmethoxy)benzamide
CID 78854576
2-(oxolan-2-ylmethoxy)-N-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
CID 43035749
2-methyl-5-[[[2-[[(2R)-oxolan-2-yl]methoxy]benzoyl]amino]methyl]furan-3-carboxylic acid
CID 125150340
2-[(4-fluorophenyl)methoxy]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide
CID 24551331
2-[[(2R)-oxolan-2-yl]methoxy]-N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 30687716
4-[[[2-(cyclopropylmethoxy)benzoyl]amino]methyl]benzoic acid
CID 119165490
1,4-diazepan-1-yl-[2-[[(2R)-oxolan-2-yl]methoxy]phenyl]methanone
CID 124610969
[2-[[(2R)-oxolan-2-yl]methoxy]phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 51927276

Frequently Asked Questions

What is the IUPAC name of N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide?
The IUPAC name of N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide (CID 25498534) is N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide.
What is the SMILES notation for N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide?
The canonical SMILES for N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide is O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1OC[C@@H]1CCCO1.
What is the InChIKey of N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide?
The InChIKey is YVLXTDBRINRBRD-FQEVSTJZSA-N. The full InChI is InChI=1S/C24H28N2O5/c27-23(21-5-1-2-6-22(21)31-17-20-4-3-13-30-20)25-16-18-7-9-19(10-8-18)24(28)26-11-14-29-15-12-26/h1-2,5-10,20H,3-4,11-17H2,(H,25,27)/t20-/m0/s1.
What are the key properties of N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide?
N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide has a molecular weight of 424.50 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(morpholine-4-carbonyl)phenyl]methyl]-2-[[(2S)-oxolan-2-yl]methoxy]benzamide is sourced from PubChem (CID 25498534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).