N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide

C21H26N2O4 — CID 42791115

IUPACN-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide
SMILESCCCn1c(C(=O)N(C)CCc2ccc(OC)c(OC)c2)cc2occc21
InChIInChI=1S/C21H26N2O4/c1-5-10-23-16-9-12-27-19(16)14-17(23)21(24)22(2)11-8-15-6-7-18(25-3)20(13-15)26-4/h6-7,9,12-14H,5,8,10-11H2,1-4H3
InChIKeyYCHVGMXYOKLMHK-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.98
Rot. Bonds8

About N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide

N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide (PubChem CID 42791115) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide
PubChem CID42791115
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC NameN-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide
SMILESCCCn1c(C(=O)N(C)CCc2ccc(OC)c(OC)c2)cc2occc21
InChIInChI=1S/C21H26N2O4/c1-5-10-23-16-9-12-27-19(16)14-17(23)21(24)22(2)11-8-15-6-7-18(25-3)20(13-15)26-4/h6-7,9,12-14H,5,8,10-11H2,1-4H3
InChIKeyYCHVGMXYOKLMHK-UHFFFAOYSA-N
XLogP3.98
TPSA56.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2-dimethyl-4-(2-methylprop-2-enyl)furo[3,2-b]pyrrole-5-carboxamide
CID 7301804
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-methoxyphenyl)methyl]furo[3,2-b]pyrrole-5-carboxamide
CID 4651741
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CID 658810
5-(2-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylfuran-2-carboxamide
CID 9085023
N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2,2,3-tetramethylbutanamide
CID 69472007
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-(trifluoromethyl)benzamide
CID 42695653
2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-(ethylcarbamoyl)acetamide
CID 8583895
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethyl-2-(furan-2-ylmethyl)-1-methylguanidine
CID 111241001
3-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-ethoxy-5-methoxy-N-methylbenzamide
CID 8001354
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide
CID 26826376
(2R)-2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-ethylpropanamide
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Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide (CID 42791115) is N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide is CCCn1c(C(=O)N(C)CCc2ccc(OC)c(OC)c2)cc2occc21.
What is the InChIKey of N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide?
The InChIKey is YCHVGMXYOKLMHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-5-10-23-16-9-12-27-19(16)14-17(23)21(24)22(2)11-8-15-6-7-18(25-3)20(13-15)26-4/h6-7,9,12-14H,5,8,10-11H2,1-4H3.
What are the key properties of N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide?
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 3.98, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-propylfuro[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 42791115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).