N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide

C21H30N2O4 — CID 139919411

IUPACN-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccco2)cc1OCCN(C(C)C)C(C)C
InChIInChI=1S/C21H30N2O4/c1-15(2)23(16(3)4)10-12-27-20-13-17(8-9-19(20)25-5)22-21(24)14-18-7-6-11-26-18/h6-9,11,13,15-16H,10,12,14H2,1-5H3,(H,22,24)
InChIKeyLAJMLJVWMMQWLK-UHFFFAOYSA-N
MW374.48 g/mol
LogP3.97
Rot. Bonds10

About N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide

N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide (PubChem CID 139919411) has the molecular formula C21H30N2O4 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide.

Molecular Properties

Compound NameN-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide
PubChem CID139919411
Molecular FormulaC21H30N2O4
Molecular Weight374.48 g/mol
Exact Mass374.22
IUPAC NameN-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccco2)cc1OCCN(C(C)C)C(C)C
InChIInChI=1S/C21H30N2O4/c1-15(2)23(16(3)4)10-12-27-20-13-17(8-9-19(20)25-5)22-21(24)14-18-7-6-11-26-18/h6-9,11,13,15-16H,10,12,14H2,1-5H3,(H,22,24)
InChIKeyLAJMLJVWMMQWLK-UHFFFAOYSA-N
XLogP3.97
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(furan-2-yl)acetamide
CID 110690712
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)acetamide
CID 139919329
2-(5-chloro-1H-indol-2-yl)-N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]acetamide
CID 139919390
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-4-(3-hydroxyphenyl)benzamide
CID 18672596
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-6-phenylpyridine-3-carboxamide
CID 22459286
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-4-(3-methoxyphenyl)benzamide
CID 18672554
(E)-3-(3,4-dimethylphenyl)-N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]prop-2-enamide
CID 70143460
3-chloro-4-(2-chlorophenyl)-N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]benzamide
CID 142006317
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-6,7-dimethoxy-2H-chromene-3-carboxamide
CID 139932885
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-2-(4-phenylphenyl)acetamide
CID 139912017
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-3-pyridin-3-ylprop-2-enamide
CID 54439942
2-(furan-2-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 110690707

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide?
The IUPAC name of N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide (CID 139919411) is N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide.
What is the SMILES notation for N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide?
The canonical SMILES for N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide is COc1ccc(NC(=O)Cc2ccco2)cc1OCCN(C(C)C)C(C)C.
What is the InChIKey of N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide?
The InChIKey is LAJMLJVWMMQWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O4/c1-15(2)23(16(3)4)10-12-27-20-13-17(8-9-19(20)25-5)22-21(24)14-18-7-6-11-26-18/h6-9,11,13,15-16H,10,12,14H2,1-5H3,(H,22,24).
What are the key properties of N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide?
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide has a molecular weight of 374.48 g/mol, XLogP of 3.97, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-2-(furan-2-yl)acetamide is sourced from PubChem (CID 139919411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).