4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide

C25H24N2O2 — CID 75768839

IUPAC4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide
SMILESCc1ccccc1Cn1c(C(=O)NC2CCCc3ccccc32)cc2occc21
InChIInChI=1S/C25H24N2O2/c1-17-7-2-3-9-19(17)16-27-22-13-14-29-24(22)15-23(27)25(28)26-21-12-6-10-18-8-4-5-11-20(18)21/h2-5,7-9,11,13-15,21H,6,10,12,16H2,1H3,(H,26,28)
InChIKeyUPYDETPBSYRJPF-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.40
Rot. Bonds4

About 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide

4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide (PubChem CID 75768839) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound Name4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide
PubChem CID75768839
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC Name4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide
SMILESCc1ccccc1Cn1c(C(=O)NC2CCCc3ccccc32)cc2occc21
InChIInChI=1S/C25H24N2O2/c1-17-7-2-3-9-19(17)16-27-22-13-14-29-24(22)15-23(27)25(28)26-21-12-6-10-18-8-4-5-11-20(18)21/h2-5,7-9,11,13-15,21H,6,10,12,16H2,1H3,(H,26,28)
InChIKeyUPYDETPBSYRJPF-UHFFFAOYSA-N
XLogP5.40
TPSA47.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-4-[(2-methylphenyl)methyl]furo[3,2-b]pyrrole-5-carboxamide
CID 75768838
2-[methyl-[(2-methylphenyl)methyl]amino]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 2543063
3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 20900031
2,5-dimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 7919785
2-amino-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 60682216
N-[(2-methylphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43079139
5-amino-2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 62304912
2-[(2,5-dimethylphenyl)methylsulfanyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 25362095
2-[(2,5-dimethylphenyl)methylsulfanyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 25362094
1-[(2-methylphenyl)methylsulfonyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
CID 43875237
N-(2,3-dihydro-1H-inden-1-yl)-2-methylfuran-3-carboxamide
CID 47015555
3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2-oxazole-4-carboxamide
CID 11149532

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide (CID 75768839) is 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide is Cc1ccccc1Cn1c(C(=O)NC2CCCc3ccccc32)cc2occc21.
What is the InChIKey of 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide?
The InChIKey is UPYDETPBSYRJPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-17-7-2-3-9-19(17)16-27-22-13-14-29-24(22)15-23(27)25(28)26-21-12-6-10-18-8-4-5-11-20(18)21/h2-5,7-9,11,13-15,21H,6,10,12,16H2,1H3,(H,26,28).
What are the key properties of 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide?
4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 5.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylphenyl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)furo[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 75768839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).