N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide

C17H18N2O2 — CID 42790627

IUPACN-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide
SMILESCc1ccc(NC(=O)c2cc3occc3n2C(C)C)cc1
InChIInChI=1S/C17H18N2O2/c1-11(2)19-14-8-9-21-16(14)10-15(19)17(20)18-13-6-4-12(3)5-7-13/h4-11H,1-3H3,(H,18,20)
InChIKeyQOPFVXFCWASNGB-UHFFFAOYSA-N
MW282.34 g/mol
LogP4.38
Rot. Bonds3

About N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide

N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide (PubChem CID 42790627) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide
PubChem CID42790627
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide
SMILESCc1ccc(NC(=O)c2cc3occc3n2C(C)C)cc1
InChIInChI=1S/C17H18N2O2/c1-11(2)19-14-8-9-21-16(14)10-15(19)17(20)18-13-6-4-12(3)5-7-13/h4-11H,1-3H3,(H,18,20)
InChIKeyQOPFVXFCWASNGB-UHFFFAOYSA-N
XLogP4.38
TPSA47.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethylphenyl)-4-(oxan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 42792525
1,5-dimethyl-N-(4-methylphenyl)indole-2-carboxamide
CID 7329101
1-methyl-3-N,5-N-bis(4-methylphenyl)pyrazole-3,5-dicarboxamide
CID 679026
4-[(3-chlorophenyl)methyl]-N-(3,4-dimethylphenyl)furo[3,2-b]pyrrole-5-carboxamide
CID 42790763
(E)-4-methyl-N-(4-methylphenyl)pent-2-enamide
CID 70821630
propan-2-yl 4-[(4-methylbenzoyl)amino]benzoate
CID 718345
2-(4-methylphenoxy)-N-(2-oxo-3-propan-2-yl-1,3-benzoxazol-6-yl)acetamide
CID 50797086
N-(4-methylphenyl)acetamide
CID 7684
4-amino-1-ethyl-N-(4-methylphenyl)pyrrole-2-carboxamide
CID 43642219
5-ethyl-1-methyl-N-(4-methylphenyl)-4-oxopyrrolo[3,2-c]pyridine-2-carboxamide
CID 53134440
5-methyl-N-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 3236095
2,5-dimethyl-N-(2-oxo-3-propan-2-yl-1,3-benzothiazol-6-yl)benzamide
CID 100560457

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide (CID 42790627) is N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide is Cc1ccc(NC(=O)c2cc3occc3n2C(C)C)cc1.
What is the InChIKey of N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide?
The InChIKey is QOPFVXFCWASNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-11(2)19-14-8-9-21-16(14)10-15(19)17(20)18-13-6-4-12(3)5-7-13/h4-11H,1-3H3,(H,18,20).
What are the key properties of N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide?
N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-4-propan-2-ylfuro[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 42790627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).