N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide

C22H23N3O3 — CID 42935867

IUPACN-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide
SMILESCc1ccccc1C(C)NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C22H23N3O3/c1-15-6-3-4-7-19(15)16(2)24-22(27)23-14-17-9-11-18(12-10-17)25-21(26)20-8-5-13-28-20/h3-13,16H,14H2,1-2H3,(H,25,26)(H2,23,24,27)
InChIKeyORGZPSGZHYEFTR-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.40
Rot. Bonds6

About N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide

N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide (PubChem CID 42935867) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide
PubChem CID42935867
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide
SMILESCc1ccccc1C(C)NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C22H23N3O3/c1-15-6-3-4-7-19(15)16(2)24-22(27)23-14-17-9-11-18(12-10-17)25-21(26)20-8-5-13-28-20/h3-13,16H,14H2,1-2H3,(H,25,26)(H2,23,24,27)
InChIKeyORGZPSGZHYEFTR-UHFFFAOYSA-N
XLogP4.40
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-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-[4-[[(3-bromo-4-methylphenyl)carbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 78870406
ethyl N-[[4-(furan-2-carbonylamino)phenyl]methyl]carbamate
CID 60712061
N-[4-[(2-phenylsulfanylpropanoylamino)methyl]phenyl]furan-2-carboxamide
CID 51327723
1-[1-(2-methylphenyl)ethyl]-3-(pyridin-3-ylmethyl)urea
CID 47014443
N-[4-[1-(2-chlorophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 51205981
N-[4-[1-(2-bromophenyl)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 24544718
N-[4-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]phenyl]furan-2-carboxamide
CID 9152076
N-[4-[(4-acetamidophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24628897
1-[(1R)-1-(2-methylphenyl)ethyl]-3-[[4-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 30311935
N-[4-[[[N'-methyl-N-[2-(2-methylphenoxy)propyl]carbamimidoyl]amino]methyl]phenyl]furan-2-carboxamide
CID 111686268
N-[3-[[1-[4-(cyclopropanecarbonylamino)phenyl]ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 55629630
N-[4-[(2-methylphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 9184242

Frequently Asked Questions

What is the IUPAC name of N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide (CID 42935867) is N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide is Cc1ccccc1C(C)NC(=O)NCc1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide?
The InChIKey is ORGZPSGZHYEFTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-15-6-3-4-7-19(15)16(2)24-22(27)23-14-17-9-11-18(12-10-17)25-21(26)20-8-5-13-28-20/h3-13,16H,14H2,1-2H3,(H,25,26)(H2,23,24,27).
What are the key properties of N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide?
N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.40, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[1-(2-methylphenyl)ethylcarbamoylamino]methyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 42935867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).