N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide

C19H22N4O4 — CID 55454336

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide
SMILESCN(C)C(CNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)c1ccco1
InChIInChI=1S/C19H22N4O4/c1-22(2)15(16-8-5-11-27-16)12-20-17(24)9-10-23-14-7-4-3-6-13(14)18(25)21-19(23)26/h3-8,11,15H,9-10,12H2,1-2H3,(H,20,24)(H,21,25,26)
InChIKeyAHIWBRXMTYMTMJ-UHFFFAOYSA-N
MW370.41 g/mol
LogP1.09
Rot. Bonds7

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide (PubChem CID 55454336) has the molecular formula C19H22N4O4 and a molecular weight of 370.41 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide
PubChem CID55454336
Molecular FormulaC19H22N4O4
Molecular Weight370.41 g/mol
Exact Mass370.16
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide
SMILESCN(C)C(CNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)c1ccco1
InChIInChI=1S/C19H22N4O4/c1-22(2)15(16-8-5-11-27-16)12-20-17(24)9-10-23-14-7-4-3-6-13(14)18(25)21-19(23)26/h3-8,11,15H,9-10,12H2,1-2H3,(H,20,24)(H,21,25,26)
InChIKeyAHIWBRXMTYMTMJ-UHFFFAOYSA-N
XLogP1.09
TPSA100.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2R)-2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide
CID 34457663
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 25488588
3-(2,4-dioxoquinazolin-1-yl)-N-[(2R)-2-phenylpropyl]propanamide
CID 26006226
3-(2,4-dioxoquinazolin-1-yl)propanehydrazide
CID 818053
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2-oxo-3-piperidin-1-ylquinoxalin-1-yl)propanamide
CID 91951394
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 93235652
3-(2,4-dioxoquinazolin-1-yl)-N-[2-(4-phenylpiperazin-1-yl)propyl]propanamide
CID 55694795
4-[3-(2,4-dioxoquinazolin-1-yl)propanoylamino]-N,N-diethylbutanamide
CID 60513440
N-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-(2,4-dioxoquinazolin-1-yl)acetamide
CID 30856713
N-benzhydryl-3-(2,4-dioxoquinazolin-1-yl)propanamide
CID 18104755
N-[(2R)-2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-(2,4-dioxoquinazolin-1-yl)acetamide
CID 30526206
2-[3-(2,4-dioxoquinazolin-1-yl)propanoylamino]butanoic acid
CID 119223783

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide (CID 55454336) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide is CN(C)C(CNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide?
The InChIKey is AHIWBRXMTYMTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4/c1-22(2)15(16-8-5-11-27-16)12-20-17(24)9-10-23-14-7-4-3-6-13(14)18(25)21-19(23)26/h3-8,11,15H,9-10,12H2,1-2H3,(H,20,24)(H,21,25,26).
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide has a molecular weight of 370.41 g/mol, XLogP of 1.09, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide is sourced from PubChem (CID 55454336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).