2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide

C20H30N2O4 — CID 133246232

IUPAC2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide
SMILESCOC(C)(C(=O)Nc1ccc(OCCCN2CCOCC2)cc1)C1CC1
InChIInChI=1S/C20H30N2O4/c1-20(24-2,16-4-5-16)19(23)21-17-6-8-18(9-7-17)26-13-3-10-22-11-14-25-15-12-22/h6-9,16H,3-5,10-15H2,1-2H3,(H,21,23)
InChIKeyGBVLAVPNYNMQKY-UHFFFAOYSA-N
MW362.47 g/mol
LogP2.54
Rot. Bonds9

About 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide

2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide (PubChem CID 133246232) has the molecular formula C20H30N2O4 and a molecular weight of 362.47 g/mol. Its IUPAC name is 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide
PubChem CID133246232
Molecular FormulaC20H30N2O4
Molecular Weight362.47 g/mol
Exact Mass362.22
IUPAC Name2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide
SMILESCOC(C)(C(=O)Nc1ccc(OCCCN2CCOCC2)cc1)C1CC1
InChIInChI=1S/C20H30N2O4/c1-20(24-2,16-4-5-16)19(23)21-17-6-8-18(9-7-17)26-13-3-10-22-11-14-25-15-12-22/h6-9,16H,3-5,10-15H2,1-2H3,(H,21,23)
InChIKeyGBVLAVPNYNMQKY-UHFFFAOYSA-N
XLogP2.54
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 52.54
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

2-cyclopropyl-2-ethoxy-N-[4-(2-morpholin-4-ylethoxy)phenyl]propanamide
CID 133246889
(2R)-2-cyclopropyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]-2-propoxypropanamide
CID 100717701
(2S)-2-methoxy-2-methyl-N-[4-(3-morpholin-4-ylpropoxy)phenyl]hexanamide
CID 100700350
2-cyclopropyl-2-methoxy-N-(4-propoxyphenyl)propanamide
CID 133246208
2-cyclopropyl-2-methoxy-N-[4-[3-(2-methylpiperidin-1-yl)propoxy]phenyl]propanamide
CID 133246235
(2S)-2-ethoxy-2,4-dimethyl-N-[4-(3-morpholin-4-ylpropoxy)phenyl]pentanamide
CID 100723548
(2R)-2-cyclopropyl-2-methoxy-N-[4-[2-[(2S)-2-methylpiperidin-1-yl]ethoxy]phenyl]propanamide
CID 100709144
N-[4-[3-(azepan-1-yl)propoxy]phenyl]-2-methoxy-2-methylpropanamide
CID 100692930
1-[4-(3-morpholin-4-ylpropoxy)phenyl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 25015279
2-ethoxy-2-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]butanamide
CID 133246288
(2S)-2-cyclopropyl-2-methoxy-N-[4-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propanamide
CID 100708900
(2S)-2-cyclopropyl-2-ethoxy-N-[4-[3-[(3S)-3-methylpiperidin-1-yl]propoxy]phenyl]propanamide
CID 125061179

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide?
The IUPAC name of 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide (CID 133246232) is 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide.
What is the SMILES notation for 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide?
The canonical SMILES for 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide is COC(C)(C(=O)Nc1ccc(OCCCN2CCOCC2)cc1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide?
The InChIKey is GBVLAVPNYNMQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O4/c1-20(24-2,16-4-5-16)19(23)21-17-6-8-18(9-7-17)26-13-3-10-22-11-14-25-15-12-22/h6-9,16H,3-5,10-15H2,1-2H3,(H,21,23).
What are the key properties of 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide?
2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide has a molecular weight of 362.47 g/mol, XLogP of 2.54, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methoxy-N-[4-(3-morpholin-4-ylpropoxy)phenyl]propanamide is sourced from PubChem (CID 133246232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).