5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide

C22H21N3O3 — CID 51123765

IUPAC5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
SMILESCC(C)N(Cc1cccnc1)C(=O)c1ccc(COc2ccccc2C#N)o1
InChIInChI=1S/C22H21N3O3/c1-16(2)25(14-17-6-5-11-24-13-17)22(26)21-10-9-19(28-21)15-27-20-8-4-3-7-18(20)12-23/h3-11,13,16H,14-15H2,1-2H3
InChIKeyCHVIZNPZLNECMV-UHFFFAOYSA-N
MW375.43 g/mol
LogP4.18
Rot. Bonds7

About 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide

5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide (PubChem CID 51123765) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
PubChem CID51123765
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
SMILESCC(C)N(Cc1cccnc1)C(=O)c1ccc(COc2ccccc2C#N)o1
InChIInChI=1S/C22H21N3O3/c1-16(2)25(14-17-6-5-11-24-13-17)22(26)21-10-9-19(28-21)15-27-20-8-4-3-7-18(20)12-23/h3-11,13,16H,14-15H2,1-2H3
InChIKeyCHVIZNPZLNECMV-UHFFFAOYSA-N
XLogP4.18
TPSA79.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(2-cyanophenoxy)methyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 51085773
5-[(2-cyanophenoxy)methyl]-N-methyl-N-propan-2-ylfuran-2-carboxamide
CID 87024322
5-[(2-methoxyphenoxy)methyl]-N-methyl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 87002082
2-(2-cyanophenoxy)-N-methyl-N-(pyridin-3-ylmethyl)acetamide
CID 43397563
N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 61215927
5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide
CID 47051131
3-phenoxy-N-propan-2-yl-N-(pyridin-3-ylmethyl)benzamide
CID 60557001
N-benzyl-3-ethoxy-N-propan-2-yl-4-(pyridin-3-ylmethoxy)benzamide
CID 52663723
5-[(2-cyanophenoxy)methyl]-N-[3-(2-methylimidazol-1-yl)propyl]furan-2-carboxamide
CID 55958481
(2S)-N-(2-cyanoethyl)-2-(2-cyanophenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 95042307
5-[(2-cyanophenoxy)methyl]-N-[(3-ethoxyphenyl)methyl]furan-2-carboxamide
CID 55844677
N-[2-(3-chlorophenyl)ethyl]-5-[(2-cyanophenoxy)methyl]furan-2-carboxamide
CID 55825170

Frequently Asked Questions

What is the IUPAC name of 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
The IUPAC name of 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide (CID 51123765) is 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
The canonical SMILES for 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide is CC(C)N(Cc1cccnc1)C(=O)c1ccc(COc2ccccc2C#N)o1.
What is the InChIKey of 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
The InChIKey is CHVIZNPZLNECMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-16(2)25(14-17-6-5-11-24-13-17)22(26)21-10-9-19(28-21)15-27-20-8-4-3-7-18(20)12-23/h3-11,13,16H,14-15H2,1-2H3.
What are the key properties of 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 4.18, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-cyanophenoxy)methyl]-N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 51123765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).