N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide

C29H27N3O4 — CID 42751989

IUPACN-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide
SMILESO=C(COCc1ccccc1)N(CC(=O)N1c2ccccc2-n2cccc2C1c1ccco1)C1CC1
InChIInChI=1S/C29H27N3O4/c33-27(18-31(22-14-15-22)28(34)20-35-19-21-8-2-1-3-9-21)32-24-11-5-4-10-23(24)30-16-6-12-25(30)29(32)26-13-7-17-36-26/h1-13,16-17,22,29H,14-15,18-20H2
InChIKeyCHQFRMDHEGFDPA-UHFFFAOYSA-N
MW481.55 g/mol
LogP4.71
Rot. Bonds8

About N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide

N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide (PubChem CID 42751989) has the molecular formula C29H27N3O4 and a molecular weight of 481.55 g/mol. Its IUPAC name is N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide
PubChem CID42751989
Molecular FormulaC29H27N3O4
Molecular Weight481.55 g/mol
Exact Mass481.20
IUPAC NameN-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide
SMILESO=C(COCc1ccccc1)N(CC(=O)N1c2ccccc2-n2cccc2C1c1ccco1)C1CC1
InChIInChI=1S/C29H27N3O4/c33-27(18-31(22-14-15-22)28(34)20-35-19-21-8-2-1-3-9-21)32-24-11-5-4-10-23(24)30-16-6-12-25(30)29(32)26-13-7-17-36-26/h1-13,16-17,22,29H,14-15,18-20H2
InChIKeyCHQFRMDHEGFDPA-UHFFFAOYSA-N
XLogP4.71
TPSA67.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.55
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopropyl-3-ethyl-1-[2-[(4R)-4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
CID 7356492
1-cyclopropyl-1-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-3-(2-methylphenyl)urea
CID 4988462
N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-3-phenyl-N-propan-2-ylpropanamide
CID 42751894
3-benzyl-1-butyl-1-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
CID 42752513
N-cyclopropyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylacetamide
CID 5031432
3-cyclopentyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-N-propan-2-ylpropanamide
CID 42659478
ethyl 4-[[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-propan-2-ylamino]-4-oxobutanoate
CID 42751905
N-cyclopropyl-2,2-dimethyl-N-[2-oxo-2-(4-phenyl-4H-pyrrolo[1,2-a]quinoxalin-5-yl)ethyl]propanamide
CID 42752122
1-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-3-(2-methoxyphenyl)-1-propan-2-ylurea
CID 42752498
N-[2-[4-(3-chlorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxy-N-propan-2-ylacetamide
CID 5227067
3-(2-ethylphenyl)-1-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-1-propan-2-ylurea
CID 42752505
N-butyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide
CID 3672809

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide?
The IUPAC name of N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide (CID 42751989) is N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide.
What is the SMILES notation for N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide?
The canonical SMILES for N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide is O=C(COCc1ccccc1)N(CC(=O)N1c2ccccc2-n2cccc2C1c1ccco1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide?
The InChIKey is CHQFRMDHEGFDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27N3O4/c33-27(18-31(22-14-15-22)28(34)20-35-19-21-8-2-1-3-9-21)32-24-11-5-4-10-23(24)30-16-6-12-25(30)29(32)26-13-7-17-36-26/h1-13,16-17,22,29H,14-15,18-20H2.
What are the key properties of N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide?
N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide has a molecular weight of 481.55 g/mol, XLogP of 4.71, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[2-[4-(furan-2-yl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-2-phenylmethoxyacetamide is sourced from PubChem (CID 42751989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).