N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide

C17H20N2O2 — CID 24532506

IUPACN-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
SMILESO=C(NCc1ccc(CN2CCCC2)cc1)c1ccoc1
InChIInChI=1S/C17H20N2O2/c20-17(16-7-10-21-13-16)18-11-14-3-5-15(6-4-14)12-19-8-1-2-9-19/h3-7,10,13H,1-2,8-9,11-12H2,(H,18,20)
InChIKeyRUQAAONLUUTVLG-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.81
Rot. Bonds5

About N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide

N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide (PubChem CID 24532506) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
PubChem CID24532506
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
SMILESO=C(NCc1ccc(CN2CCCC2)cc1)c1ccoc1
InChIInChI=1S/C17H20N2O2/c20-17(16-7-10-21-13-16)18-11-14-3-5-15(6-4-14)12-19-8-1-2-9-19/h3-7,10,13H,1-2,8-9,11-12H2,(H,18,20)
InChIKeyRUQAAONLUUTVLG-UHFFFAOYSA-N
XLogP2.81
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-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-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]furan-3-carboxamide
CID 39997651
4-(piperidin-1-ylmethyl)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 24654968
N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]furan-3-carboxamide
CID 18153751
N-[2-[[3-(azepan-1-ylmethyl)phenyl]methylamino]-2-oxoethyl]furan-3-carboxamide
CID 49086013
N-[[4-(hydroxymethyl)phenyl]methyl]-4-(piperidin-1-ylmethyl)benzamide
CID 131952254
N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furan-3-carboxamide
CID 46450029
4-(piperidin-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide
CID 17398321
N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]furan-3-carboxamide
CID 18132522
N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]naphthalene-2-carboxamide
CID 9049744
N-[[4-(azepan-1-ylmethyl)phenyl]methyl]-2-chloropyridine-4-carboxamide
CID 60602338
N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide
CID 122157149
N-[[4-[(dimethylamino)methyl]phenyl]methyl]furan-3-carboxamide
CID 31544582

Frequently Asked Questions

What is the IUPAC name of N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide?
The IUPAC name of N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide (CID 24532506) is N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide.
What is the SMILES notation for N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide?
The canonical SMILES for N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide is O=C(NCc1ccc(CN2CCCC2)cc1)c1ccoc1.
What is the InChIKey of N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide?
The InChIKey is RUQAAONLUUTVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-17(16-7-10-21-13-16)18-11-14-3-5-15(6-4-14)12-19-8-1-2-9-19/h3-7,10,13H,1-2,8-9,11-12H2,(H,18,20).
What are the key properties of N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide?
N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]furan-3-carboxamide is sourced from PubChem (CID 24532506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).