5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide

C20H24N2O2 — CID 131893923

IUPAC5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide
SMILESO=C(NC1CCc2ccccc2C1)c1ccc(CN2CCCC2)o1
InChIInChI=1S/C20H24N2O2/c23-20(19-10-9-18(24-19)14-22-11-3-4-12-22)21-17-8-7-15-5-1-2-6-16(15)13-17/h1-2,5-6,9-10,17H,3-4,7-8,11-14H2,(H,21,23)
InChIKeyACFNNSOPVCABNQ-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.16
Rot. Bonds4

About 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide

5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide (PubChem CID 131893923) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide
PubChem CID131893923
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide
SMILESO=C(NC1CCc2ccccc2C1)c1ccc(CN2CCCC2)o1
InChIInChI=1S/C20H24N2O2/c23-20(19-10-9-18(24-19)14-22-11-3-4-12-22)21-17-8-7-15-5-1-2-6-16(15)13-17/h1-2,5-6,9-10,17H,3-4,7-8,11-14H2,(H,21,23)
InChIKeyACFNNSOPVCABNQ-UHFFFAOYSA-N
XLogP3.16
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-oxoazepan-3-yl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
CID 131897507
N-(2-bromophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 35332804
N-(2-cyanophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19416050
N-ethyl-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19416150
N-(2,6-dichlorophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide
CID 19415907
2-chloro-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 11775776
N-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-5-[(dimethylamino)methyl]furan-2-carboxamide
CID 45193739
N-[6-(azepan-1-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-(4-fluorophenyl)benzamide
CID 11476595
2,6-difluoro-N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
CID 95271360
2,6-difluoro-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
CID 95271362
2-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 60630141
N-hexyl-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
CID 19414016

Frequently Asked Questions

What is the IUPAC name of 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide?
The IUPAC name of 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide (CID 131893923) is 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide.
What is the SMILES notation for 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide?
The canonical SMILES for 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide is O=C(NC1CCc2ccccc2C1)c1ccc(CN2CCCC2)o1.
What is the InChIKey of 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide?
The InChIKey is ACFNNSOPVCABNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-20(19-10-9-18(24-19)14-22-11-3-4-12-22)21-17-8-7-15-5-1-2-6-16(15)13-17/h1-2,5-6,9-10,17H,3-4,7-8,11-14H2,(H,21,23).
What are the key properties of 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide?
5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide has a molecular weight of 324.42 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(pyrrolidin-1-ylmethyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)furan-2-carboxamide is sourced from PubChem (CID 131893923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).