N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide

C23H24N4O4 — CID 42809443

IUPACN-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide
SMILESCOCCN(CCC(=O)NCc1ccco1)c1nc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C23H24N4O4/c1-29-15-12-27(11-10-21(28)24-16-17-6-4-13-30-17)23-18-7-2-3-8-19(18)25-22(26-23)20-9-5-14-31-20/h2-9,13-14H,10-12,15-16H2,1H3,(H,24,28)
InChIKeyWYGHIVRUGIVYEV-UHFFFAOYSA-N
MW420.47 g/mol
LogP3.64
Rot. Bonds10

About N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide

N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide (PubChem CID 42809443) has the molecular formula C23H24N4O4 and a molecular weight of 420.47 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide
PubChem CID42809443
Molecular FormulaC23H24N4O4
Molecular Weight420.47 g/mol
Exact Mass420.18
IUPAC NameN-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide
SMILESCOCCN(CCC(=O)NCc1ccco1)c1nc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C23H24N4O4/c1-29-15-12-27(11-10-21(28)24-16-17-6-4-13-30-17)23-18-7-2-3-8-19(18)25-22(26-23)20-9-5-14-31-20/h2-9,13-14H,10-12,15-16H2,1H3,(H,24,28)
InChIKeyWYGHIVRUGIVYEV-UHFFFAOYSA-N
XLogP3.64
TPSA93.63 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-[[2-(3-bromophenyl)quinazolin-4-yl]-(2-methoxyethyl)amino]-N-(furan-2-ylmethyl)propanamide
CID 42809506
N-(furan-2-ylmethyl)-3-[2-methylpropyl-(2-phenylquinazolin-4-yl)amino]propanamide
CID 46133910
3-[[2-(2-chlorophenyl)quinazolin-4-yl]-propylamino]-N-(furan-2-ylmethyl)propanamide
CID 83273334
N-[(2S)-butan-2-yl]-3-[[7-chloro-2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide
CID 93299995
3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-phenylethyl)amino]-N-[(1R)-1-phenylethyl]propanamide
CID 93300001
3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methylpropyl)amino]-N-[(1S)-1-phenylethyl]propanamide
CID 93299874
N-(furan-2-ylmethyl)-3-[2-methoxyethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide
CID 3901093
N-(furan-2-ylmethylcarbamoyl)-2-[2-methoxyethyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]acetamide
CID 135809310
methyl 2-[[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetyl]amino]acetate
CID 17444323
N-(3-fluorophenyl)-3-[furan-2-ylmethyl-(2-phenylquinazolin-4-yl)amino]propanamide
CID 42809565
N-(furan-2-ylmethyl)-4-methoxyquinoline-2-carboxamide
CID 71824016
3-[[2-(3-bromophenyl)quinazolin-4-yl]-(2-methoxyethyl)amino]-N-butan-2-ylpropanamide
CID 83281449

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide (CID 42809443) is N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide is COCCN(CCC(=O)NCc1ccco1)c1nc(-c2ccco2)nc2ccccc12.
What is the InChIKey of N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide?
The InChIKey is WYGHIVRUGIVYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O4/c1-29-15-12-27(11-10-21(28)24-16-17-6-4-13-30-17)23-18-7-2-3-8-19(18)25-22(26-23)20-9-5-14-31-20/h2-9,13-14H,10-12,15-16H2,1H3,(H,24,28).
What are the key properties of N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide?
N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide has a molecular weight of 420.47 g/mol, XLogP of 3.64, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-[[2-(furan-2-yl)quinazolin-4-yl]-(2-methoxyethyl)amino]propanamide is sourced from PubChem (CID 42809443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).