1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea

C23H25N3O4 — CID 60569684

IUPAC1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea
SMILESCc1c(NC(=O)NC(C)c2cc3ccccc3o2)cccc1C(=O)N1CCOCC1
InChIInChI=1S/C23H25N3O4/c1-15-18(22(27)26-10-12-29-13-11-26)7-5-8-19(15)25-23(28)24-16(2)21-14-17-6-3-4-9-20(17)30-21/h3-9,14,16H,10-13H2,1-2H3,(H2,24,25,28)
InChIKeyZHLRUOCKQWJLHA-UHFFFAOYSA-N
MW407.47 g/mol
LogP4.10
Rot. Bonds4

About 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea

1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea (PubChem CID 60569684) has the molecular formula C23H25N3O4 and a molecular weight of 407.47 g/mol. Its IUPAC name is 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea.

Molecular Properties

Compound Name1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea
PubChem CID60569684
Molecular FormulaC23H25N3O4
Molecular Weight407.47 g/mol
Exact Mass407.18
IUPAC Name1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea
SMILESCc1c(NC(=O)NC(C)c2cc3ccccc3o2)cccc1C(=O)N1CCOCC1
InChIInChI=1S/C23H25N3O4/c1-15-18(22(27)26-10-12-29-13-11-26)7-5-8-19(15)25-23(28)24-16(2)21-14-17-6-3-4-9-20(17)30-21/h3-9,14,16H,10-13H2,1-2H3,(H2,24,25,28)
InChIKeyZHLRUOCKQWJLHA-UHFFFAOYSA-N
XLogP4.10
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]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

2-cyclopropyl-N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]propanamide
CID 126786282
1-[(2-chlorophenyl)methyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea
CID 60569430
1-[1-(1-benzofuran-2-yl)ethyl]-3-isoquinolin-5-ylurea
CID 71900533
4-[[2-methyl-3-(morpholine-4-carbonyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122077590
1-[(2,4-dichlorophenyl)methyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea
CID 60569614
N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119304348
1-[2-methyl-3-(morpholine-4-carbonyl)phenyl]-3-(2-pyridin-2-ylethyl)urea
CID 60569503
1-[1-(1-benzofuran-2-yl)ethyl]-3-(3-ethyl-2-morpholin-4-ylpentyl)urea
CID 46493943
1-[1-(1-benzofuran-2-yl)ethyl]-3-[(2-methylfuran-3-carbonyl)amino]urea
CID 43058742
2-(4-methylphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 4933116
1-[1-(1-benzofuran-2-yl)ethyl]-3-[1-(oxolan-2-yl)ethyl]urea
CID 43061447
2-[[(1S)-1-(1-benzofuran-2-yl)ethyl]carbamoylamino]propanediamide
CID 94056544

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea?
The IUPAC name of 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea (CID 60569684) is 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea.
What is the SMILES notation for 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea?
The canonical SMILES for 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea is Cc1c(NC(=O)NC(C)c2cc3ccccc3o2)cccc1C(=O)N1CCOCC1.
What is the InChIKey of 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea?
The InChIKey is ZHLRUOCKQWJLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O4/c1-15-18(22(27)26-10-12-29-13-11-26)7-5-8-19(15)25-23(28)24-16(2)21-14-17-6-3-4-9-20(17)30-21/h3-9,14,16H,10-13H2,1-2H3,(H2,24,25,28).
What are the key properties of 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea?
1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea has a molecular weight of 407.47 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-benzofuran-2-yl)ethyl]-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea is sourced from PubChem (CID 60569684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).