N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide

C24H25Cl2N3O2 — CID 71661038

IUPACN-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide
SMILESCC(=O)N(Cc1cc(Cl)ccc1Cl)C1(C(=O)N2CCN(C3CC3)c3ccccc32)CC1
InChIInChI=1S/C24H25Cl2N3O2/c1-16(30)29(15-17-14-18(25)6-9-20(17)26)24(10-11-24)23(31)28-13-12-27(19-7-8-19)21-4-2-3-5-22(21)28/h2-6,9,14,19H,7-8,10-13,15H2,1H3
InChIKeyDUZOQLSTUGWFKU-UHFFFAOYSA-N
MW458.39 g/mol
LogP4.89
Rot. Bonds5

About N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide

N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide (PubChem CID 71661038) has the molecular formula C24H25Cl2N3O2 and a molecular weight of 458.39 g/mol. Its IUPAC name is N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide
PubChem CID71661038
Molecular FormulaC24H25Cl2N3O2
Molecular Weight458.39 g/mol
Exact Mass457.13
IUPAC NameN-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide
SMILESCC(=O)N(Cc1cc(Cl)ccc1Cl)C1(C(=O)N2CCN(C3CC3)c3ccccc32)CC1
InChIInChI=1S/C24H25Cl2N3O2/c1-16(30)29(15-17-14-18(25)6-9-20(17)26)24(10-11-24)23(31)28-13-12-27(19-7-8-19)21-4-2-3-5-22(21)28/h2-6,9,14,19H,7-8,10-13,15H2,1H3
InChIKeyDUZOQLSTUGWFKU-UHFFFAOYSA-N
XLogP4.89
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.39
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide?
The IUPAC name of N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide (CID 71661038) is N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide.
What is the SMILES notation for N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide?
The canonical SMILES for N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide is CC(=O)N(Cc1cc(Cl)ccc1Cl)C1(C(=O)N2CCN(C3CC3)c3ccccc32)CC1.
What is the InChIKey of N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide?
The InChIKey is DUZOQLSTUGWFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25Cl2N3O2/c1-16(30)29(15-17-14-18(25)6-9-20(17)26)24(10-11-24)23(31)28-13-12-27(19-7-8-19)21-4-2-3-5-22(21)28/h2-6,9,14,19H,7-8,10-13,15H2,1H3.
What are the key properties of N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide?
N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide has a molecular weight of 458.39 g/mol, XLogP of 4.89, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)cyclopropyl]-N-[(2,5-dichlorophenyl)methyl]acetamide is sourced from PubChem (CID 71661038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).