N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide

C17H24N2O2 — CID 43020166

IUPACN-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide
SMILESO=C(NCc1ccccc1CN1CCCC1)C1CCCO1
InChIInChI=1S/C17H24N2O2/c20-17(16-8-5-11-21-16)18-12-14-6-1-2-7-15(14)13-19-9-3-4-10-19/h1-2,6-7,16H,3-5,8-13H2,(H,18,20)
InChIKeyKKTMXPZSGSBYPX-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.08
Rot. Bonds5

About N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide

N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide (PubChem CID 43020166) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide
PubChem CID43020166
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide
SMILESO=C(NCc1ccccc1CN1CCCC1)C1CCCO1
InChIInChI=1S/C17H24N2O2/c20-17(16-8-5-11-21-16)18-12-14-6-1-2-7-15(14)13-19-9-3-4-10-19/h1-2,6-7,16H,3-5,8-13H2,(H,18,20)
InChIKeyKKTMXPZSGSBYPX-UHFFFAOYSA-N
XLogP2.08
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]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-(1-phenylpropyl)oxolane-2-carboxamide
CID 6467126
4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(tetrahydro-2-furanylmethyl)butanamide
CID 2953906
N-[1-(3,4-dimethylphenyl)ethyl]oxolane-2-carboxamide
CID 2970814
N-[2-(4-fluorophenyl)ethyl]oxolane-2-carboxamide
CID 2947967
N-[1-(4-ethylphenyl)ethyl]tetrahydro-2-furancarboxamide
CID 6464227
N-[1-(4-butan-2-ylphenyl)propyl]oxolane-2-carboxamide
CID 6464301
N-[1-(2,5-dimethylphenyl)ethyl]oxolane-2-carboxamide
CID 6469248
N-(1-phenylethyl)tetrahydro-2-furancarboxamide
CID 2931490
(2S)-N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-1-[(2R)-oxolane-2-carbonyl]pyrrolidine-2-carboxamide
CID 76072670
N-(1,2,3,4-tetrahydro-1-naphthalenyl)tetrahydro-2-furancarboxamide
CID 2970727
N-(3-phenylpropyl)oxolane-2-carboxamide
CID 4108536
N-(diphenylmethyl)oxolane-2-carboxamide
CID 3155117

Frequently Asked Questions

What is the IUPAC name of N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide?
The IUPAC name of N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide (CID 43020166) is N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide?
The canonical SMILES for N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide is O=C(NCc1ccccc1CN1CCCC1)C1CCCO1.
What is the InChIKey of N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide?
The InChIKey is KKTMXPZSGSBYPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c20-17(16-8-5-11-21-16)18-12-14-6-1-2-7-15(14)13-19-9-3-4-10-19/h1-2,6-7,16H,3-5,8-13H2,(H,18,20).
What are the key properties of N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide?
N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]oxolane-2-carboxamide is sourced from PubChem (CID 43020166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).