5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide

C21H21N3O3 — CID 43041629

IUPAC5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)nc1)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C21H21N3O3/c25-21(23-16-8-11-20(22-14-16)24-12-4-5-13-24)19-10-9-18(27-19)15-26-17-6-2-1-3-7-17/h1-3,6-11,14H,4-5,12-13,15H2,(H,23,25)
InChIKeyDECNABXFSKLGSX-UHFFFAOYSA-N
MW363.42 g/mol
LogP4.11
Rot. Bonds6

About 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide

5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide (PubChem CID 43041629) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide
PubChem CID43041629
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC Name5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)nc1)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C21H21N3O3/c25-21(23-16-8-11-20(22-14-16)24-12-4-5-13-24)19-10-9-18(27-19)15-26-17-6-2-1-3-7-17/h1-3,6-11,14H,4-5,12-13,15H2,(H,23,25)
InChIKeyDECNABXFSKLGSX-UHFFFAOYSA-N
XLogP4.11
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-phenylmethoxyphenoxy)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
CID 134035859
N-(4-phenylmethoxyphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109152128
N-(4-phenylmethoxyphenyl)-6-piperidin-1-ylpyridine-3-carboxamide
CID 109152321
5-(phenoxymethyl)-N-quinolin-3-ylfuran-2-carboxamide
CID 31031057
1-[5-[[5-(benzenesulfonylmethyl)furan-2-carbonyl]amino]-2-pyridinyl]piperidine-3-carboxamide
CID 55700999
N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 31289277
5-[(4-methylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 7454734
4-ethoxy-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 41303356
N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 46584687
5-[(4-methoxyphenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]furan-2-carboxamide
CID 19451165
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 26774462
N-[6-(azepan-1-yl)-3-pyridinyl]-3,3-diphenylpropanamide
CID 113015896

Frequently Asked Questions

What is the IUPAC name of 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide?
The IUPAC name of 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide (CID 43041629) is 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide?
The canonical SMILES for 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide is O=C(Nc1ccc(N2CCCC2)nc1)c1ccc(COc2ccccc2)o1.
What is the InChIKey of 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide?
The InChIKey is DECNABXFSKLGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c25-21(23-16-8-11-20(22-14-16)24-12-4-5-13-24)19-10-9-18(27-19)15-26-17-6-2-1-3-7-17/h1-3,6-11,14H,4-5,12-13,15H2,(H,23,25).
What are the key properties of 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide?
5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(phenoxymethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 43041629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).