N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide

C16H22N2O3 — CID 110361978

IUPACN-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
SMILESCOc1ccc(N2CCCC2)cc1NC(=O)C1CCCO1
InChIInChI=1S/C16H22N2O3/c1-20-14-7-6-12(18-8-2-3-9-18)11-13(14)17-16(19)15-5-4-10-21-15/h6-7,11,15H,2-5,8-10H2,1H3,(H,17,19)
InChIKeyDXMHWSQCENVACV-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.41
Rot. Bonds4

About N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide

N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide (PubChem CID 110361978) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
PubChem CID110361978
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
SMILESCOc1ccc(N2CCCC2)cc1NC(=O)C1CCCO1
InChIInChI=1S/C16H22N2O3/c1-20-14-7-6-12(18-8-2-3-9-18)11-13(14)17-16(19)15-5-4-10-21-15/h6-7,11,15H,2-5,8-10H2,1H3,(H,17,19)
InChIKeyDXMHWSQCENVACV-UHFFFAOYSA-N
XLogP2.41
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide
CID 110362184
N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide
CID 110426214
N-(2-methoxy-5-piperidin-1-ylphenyl)-2-(oxan-2-yl)acetamide
CID 110613190
N-[4-(azepan-1-yl)phenyl]oxolane-2-carboxamide
CID 51197534
3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide
CID 110359680
(2S)-N-(4-fluoro-2-methoxyphenyl)oxolane-2-carboxamide
CID 32608102
N-(3-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
CID 47255294
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]oxolane-2-carboxamide
CID 112984476
2-cyclopropyl-N-(2-methoxy-5-piperidin-1-ylphenyl)propanamide
CID 110613175
N-(3-tert-butyl-4-methoxyphenyl)oxolane-2-carboxamide
CID 110776693
(2R)-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
CID 2476290
N-[2-methoxy-5-(pyrrolidine-1-carbonyl)phenyl]morpholine-2-carboxamide
CID 119755679

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide?
The IUPAC name of N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide (CID 110361978) is N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide is COc1ccc(N2CCCC2)cc1NC(=O)C1CCCO1.
What is the InChIKey of N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide?
The InChIKey is DXMHWSQCENVACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-20-14-7-6-12(18-8-2-3-9-18)11-13(14)17-16(19)15-5-4-10-21-15/h6-7,11,15H,2-5,8-10H2,1H3,(H,17,19).
What are the key properties of N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide?
N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 110361978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).