1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea

C18H23N3O2 — CID 24664373

IUPAC1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea
SMILESO=C(NCc1ccccc1)NCC(c1ccco1)N1CCCC1
InChIInChI=1S/C18H23N3O2/c22-18(19-13-15-7-2-1-3-8-15)20-14-16(17-9-6-12-23-17)21-10-4-5-11-21/h1-3,6-9,12,16H,4-5,10-11,13-14H2,(H2,19,20,22)
InChIKeyYRYNKPLQOSGTLI-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.92
Rot. Bonds6

About 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea

1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea (PubChem CID 24664373) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea.

Molecular Properties

Compound Name1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea
PubChem CID24664373
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea
SMILESO=C(NCc1ccccc1)NCC(c1ccco1)N1CCCC1
InChIInChI=1S/C18H23N3O2/c22-18(19-13-15-7-2-1-3-8-15)20-14-16(17-9-6-12-23-17)21-10-4-5-11-21/h1-3,6-9,12,16H,4-5,10-11,13-14H2,(H2,19,20,22)
InChIKeyYRYNKPLQOSGTLI-UHFFFAOYSA-N
XLogP2.92
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea 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

1-[(4-chlorophenyl)methyl]-3-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea
CID 36872492
1-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-3-phenylurea
CID 112503366
1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea
CID 51291063
1-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 71930287
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-phenylpropanamide
CID 7780304
N-benzyl-N'-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217143
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide;hydrochloride
CID 52985069
N-benzyl-2-[[ethylamino-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]methylidene]amino]acetamide
CID 111304523
phenyl N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]carbamate
CID 112503288
1-[(1,5-dimethylpyrrol-2-yl)methyl]-3-[2-(furan-2-yl)-2-piperidin-1-ylethyl]urea
CID 51116327
1-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(3-hydroxybutyl)urea
CID 111336996
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2,2-diphenylacetamide;hydrochloride
CID 52984942

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea?
The IUPAC name of 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea (CID 24664373) is 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea.
What is the SMILES notation for 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea?
The canonical SMILES for 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea is O=C(NCc1ccccc1)NCC(c1ccco1)N1CCCC1.
What is the InChIKey of 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea?
The InChIKey is YRYNKPLQOSGTLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c22-18(19-13-15-7-2-1-3-8-15)20-14-16(17-9-6-12-23-17)21-10-4-5-11-21/h1-3,6-9,12,16H,4-5,10-11,13-14H2,(H2,19,20,22).
What are the key properties of 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea?
1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea has a molecular weight of 313.40 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]urea is sourced from PubChem (CID 24664373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).