4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide

C20H30N2O4 — CID 135104850

IUPAC4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide
SMILESCOc1ccc(C(=O)NCCCCC2CCCO2)cc1N1CCOCC1
InChIInChI=1S/C20H30N2O4/c1-24-19-8-7-16(15-18(19)22-10-13-25-14-11-22)20(23)21-9-3-2-5-17-6-4-12-26-17/h7-8,15,17H,2-6,9-14H2,1H3,(H,21,23)
InChIKeyMEWVRTOFLDPQMW-UHFFFAOYSA-N
MW362.47 g/mol
LogP2.61
Rot. Bonds8

About 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide

4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide (PubChem CID 135104850) has the molecular formula C20H30N2O4 and a molecular weight of 362.47 g/mol. Its IUPAC name is 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide.

Molecular Properties

Compound Name4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide
PubChem CID135104850
Molecular FormulaC20H30N2O4
Molecular Weight362.47 g/mol
Exact Mass362.22
IUPAC Name4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide
SMILESCOc1ccc(C(=O)NCCCCC2CCCO2)cc1N1CCOCC1
InChIInChI=1S/C20H30N2O4/c1-24-19-8-7-16(15-18(19)22-10-13-25-14-11-22)20(23)21-9-3-2-5-17-6-4-12-26-17/h7-8,15,17H,2-6,9-14H2,1H3,(H,21,23)
InChIKeyMEWVRTOFLDPQMW-UHFFFAOYSA-N
XLogP2.61
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
CID 18892278
3-(6-methoxypyridazin-3-yl)-N-[4-(oxolan-2-yl)butyl]benzamide
CID 118773753
(4-methoxy-3-morpholin-4-ylphenyl)-[(2S)-2-(3-methoxypropyl)piperidin-1-yl]methanone
CID 97113189
2,6-dimethyl-N-[4-(oxolan-2-yl)butyl]pyridine-4-carboxamide
CID 131899729
6-methyl-N-[4-(oxolan-2-yl)butyl]pyridine-3-carboxamide
CID 135119031
3,4-dimethyl-N-[3-(oxolan-2-ylmethoxy)propyl]benzamide
CID 134000506
N-[(3-hydroxypyrrolidin-3-yl)methyl]-4-methoxy-3-morpholin-4-ylbenzamide
CID 56894840
N-[[(3S)-3,4-dihydro-2H-chromen-3-yl]methyl]-4-methoxy-3-morpholin-4-ylbenzamide
CID 97277367
methyl 3-[2-(oxolan-2-yl)ethylcarbamoyl]benzoate
CID 51086480
3-chloro-4-methoxy-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 7426624
3-methoxy-N-[3-(oxolan-2-ylmethoxy)propyl]benzamide
CID 134000631
4-morpholin-4-yl-3-nitro-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 7378817

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide?
The IUPAC name of 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide (CID 135104850) is 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide.
What is the SMILES notation for 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide?
The canonical SMILES for 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide is COc1ccc(C(=O)NCCCCC2CCCO2)cc1N1CCOCC1.
What is the InChIKey of 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide?
The InChIKey is MEWVRTOFLDPQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O4/c1-24-19-8-7-16(15-18(19)22-10-13-25-14-11-22)20(23)21-9-3-2-5-17-6-4-12-26-17/h7-8,15,17H,2-6,9-14H2,1H3,(H,21,23).
What are the key properties of 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide?
4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide has a molecular weight of 362.47 g/mol, XLogP of 2.61, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide is sourced from PubChem (CID 135104850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).