(3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide

C19H20N2O3 — CID 92709032

IUPAC(3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide
SMILESCOc1ccc(CNC(=O)C[C@H](c2ccco2)n2cccc2)cc1
InChIInChI=1S/C19H20N2O3/c1-23-16-8-6-15(7-9-16)14-20-19(22)13-17(18-5-4-12-24-18)21-10-2-3-11-21/h2-12,17H,13-14H2,1H3,(H,20,22)/t17-/m1/s1
InChIKeyWKBGHVYQQUSNDC-QGZVFWFLSA-N
MW324.38 g/mol
LogP3.39
Rot. Bonds7

About (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide

(3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide (PubChem CID 92709032) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide.

Molecular Properties

Compound Name(3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide
PubChem CID92709032
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name(3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide
SMILESCOc1ccc(CNC(=O)C[C@H](c2ccco2)n2cccc2)cc1
InChIInChI=1S/C19H20N2O3/c1-23-16-8-6-15(7-9-16)14-20-19(22)13-17(18-5-4-12-24-18)21-10-2-3-11-21/h2-12,17H,13-14H2,1H3,(H,20,22)/t17-/m1/s1
InChIKeyWKBGHVYQQUSNDC-QGZVFWFLSA-N
XLogP3.39
TPSA56.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-3-(furan-2-yl)-3-pyrrol-1-ylpropanamide
CID 46342550
(3R)-N-[(4-methoxyphenyl)methyl]-3-(3-methylphenyl)-3-pyrrol-1-ylpropanamide
CID 92709852
(3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)-3-pyrrol-1-ylpropanamide
CID 92709119
(3S)-N-(4-ethylphenyl)-3-(furan-2-yl)-3-pyrrol-1-ylpropanamide
CID 92709021
N-[(4-methoxyphenyl)methyl]-3-methylbutanamide
CID 877839
N'-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-N-[(4-methoxyphenyl)methyl]oxamide
CID 7217228
3-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide
CID 46342627
(3S)-3-(furan-2-yl)-N-(4-methylphenyl)-3-pyrrol-1-ylpropanamide
CID 92709071
(3S)-3-(2,3-dimethoxyphenyl)-N-[(4-methylphenyl)methyl]-3-pyrrol-1-ylpropanamide
CID 92709260
(2S)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-[(4-methoxyphenyl)methyl]propanamide
CID 8755264
N-[(4-methoxyphenyl)methyl]-2-sulfanylacetamide
CID 58957123
(3S)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-4-methylpentanamide
CID 7082801

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide?
The IUPAC name of (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide (CID 92709032) is (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide.
What is the SMILES notation for (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide?
The canonical SMILES for (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide is COc1ccc(CNC(=O)C[C@H](c2ccco2)n2cccc2)cc1.
What is the InChIKey of (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide?
The InChIKey is WKBGHVYQQUSNDC-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-23-16-8-6-15(7-9-16)14-20-19(22)13-17(18-5-4-12-24-18)21-10-2-3-11-21/h2-12,17H,13-14H2,1H3,(H,20,22)/t17-/m1/s1.
What are the key properties of (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide?
(3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide has a molecular weight of 324.38 g/mol, XLogP of 3.39, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-3-pyrrol-1-ylpropanamide is sourced from PubChem (CID 92709032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).