4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide

C16H22N2O3 — CID 42792645

IUPAC4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide
SMILESCOCCCNC(=O)c1cc2occc2n1CC1CCC1
InChIInChI=1S/C16H22N2O3/c1-20-8-3-7-17-16(19)14-10-15-13(6-9-21-15)18(14)11-12-4-2-5-12/h6,9-10,12H,2-5,7-8,11H2,1H3,(H,17,19)
InChIKeyOIMNDZNLAQJVRT-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.80
Rot. Bonds7

About 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide

4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide (PubChem CID 42792645) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound Name4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide
PubChem CID42792645
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide
SMILESCOCCCNC(=O)c1cc2occc2n1CC1CCC1
InChIInChI=1S/C16H22N2O3/c1-20-8-3-7-17-16(19)14-10-15-13(6-9-21-15)18(14)11-12-4-2-5-12/h6,9-10,12H,2-5,7-8,11H2,1H3,(H,17,19)
InChIKeyOIMNDZNLAQJVRT-UHFFFAOYSA-N
XLogP2.80
TPSA56.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(cyclobutylmethyl)-N-[2-(dimethylamino)ethyl]furo[3,2-b]pyrrole-5-carboxamide
CID 7361911
N,4-dibutylfuro[3,2-b]pyrrole-5-carboxamide
CID 3637931
4-benzyl-N-(3-hydroxypropyl)furo[3,2-b]pyrrole-5-carboxamide
CID 45496120
4-[(3,5-dimethoxyphenyl)methyl]-N-[2-(dimethylamino)ethyl]furo[3,2-b]pyrrole-5-carboxamide
CID 42792526
N-(3,4-dimethylphenyl)-4-(oxan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 42792525
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-methoxyphenyl)methyl]furo[3,2-b]pyrrole-5-carboxamide
CID 4651741
4-[(3-chlorophenyl)methyl]-N-(2-piperidin-1-ylethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 3966910
4-[(2,5-dimethylphenyl)methyl]-N-(2-phenylethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 7201900
N-(3-methoxypropyl)-2-methylpyrazole-3-carboxamide
CID 19475749
(2R)-2-(furan-2-yl)-N-(3-methoxypropyl)pyrrolidine-1-carboxamide
CID 51551008
N-(3-methoxypropyl)-1-methyl-[1]benzofuro[3,2-b]pyrrole-2-carboxamide
CID 20893916
4-bromo-1-cyclopropyl-N-(3-methoxypropyl)pyrrole-2-carboxamide
CID 43641446

Frequently Asked Questions

What is the IUPAC name of 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide (CID 42792645) is 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide is COCCCNC(=O)c1cc2occc2n1CC1CCC1.
What is the InChIKey of 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide?
The InChIKey is OIMNDZNLAQJVRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-20-8-3-7-17-16(19)14-10-15-13(6-9-21-15)18(14)11-12-4-2-5-12/h6,9-10,12H,2-5,7-8,11H2,1H3,(H,17,19).
What are the key properties of 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide?
4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylmethyl)-N-(3-methoxypropyl)furo[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 42792645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).