N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide

C18H26N2O4 — CID 84560052

IUPACN-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(C(O)CCN2CCOCC2)cc1)C1CCCO1
InChIInChI=1S/C18H26N2O4/c21-16(7-8-20-9-12-23-13-10-20)14-3-5-15(6-4-14)19-18(22)17-2-1-11-24-17/h3-6,16-17,21H,1-2,7-13H2,(H,19,22)
InChIKeyJBXLGCMQIGAPEA-UHFFFAOYSA-N
MW334.42 g/mol
LogP1.56
Rot. Bonds6

About N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide

N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide (PubChem CID 84560052) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide
PubChem CID84560052
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC NameN-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(C(O)CCN2CCOCC2)cc1)C1CCCO1
InChIInChI=1S/C18H26N2O4/c21-16(7-8-20-9-12-23-13-10-20)14-3-5-15(6-4-14)19-18(22)17-2-1-11-24-17/h3-6,16-17,21H,1-2,7-13H2,(H,19,22)
InChIKeyJBXLGCMQIGAPEA-UHFFFAOYSA-N
XLogP1.56
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
CID 2476290
(2R)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]oxolane-2-carboxamide
CID 94391676
5-bromo-N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]furan-2-carboxamide
CID 84559000
(2R)-N-(4-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 975970
N-[4-(azepan-1-yl)phenyl]oxolane-2-carboxamide
CID 51197534
2-(1,3-dioxoisoindol-2-yl)-N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]acetamide
CID 84558804
2-(4-chlorophenoxy)-N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]acetamide
CID 84559932
N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 3238521
N-phenyloxolane-2-carboxamide
CID 3453643
N-[4-(bromomethyl)phenyl]oxolane-2-carboxamide
CID 114310850
(2R)-N-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]oxolane-2-carboxamide
CID 94118926
N-(4-ethylsulfanylphenyl)oxolane-2-carboxamide
CID 110778617

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide (CID 84560052) is N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide is O=C(Nc1ccc(C(O)CCN2CCOCC2)cc1)C1CCCO1.
What is the InChIKey of N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide?
The InChIKey is JBXLGCMQIGAPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4/c21-16(7-8-20-9-12-23-13-10-20)14-3-5-15(6-4-14)19-18(22)17-2-1-11-24-17/h3-6,16-17,21H,1-2,7-13H2,(H,19,22).
What are the key properties of N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide?
N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 1.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 84560052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).