N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide

C23H28N6O3 — CID 91951592

IUPACN-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
SMILESCC(C1CC1)n1nccc1NC(=O)CCn1c(=O)c(N2CCOCC2)nc2ccccc21
InChIInChI=1S/C23H28N6O3/c1-16(17-6-7-17)29-20(8-10-24-29)26-21(30)9-11-28-19-5-3-2-4-18(19)25-22(23(28)31)27-12-14-32-15-13-27/h2-5,8,10,16-17H,6-7,9,11-15H2,1H3,(H,26,30)
InChIKeyUQRSNNFOZILBNE-UHFFFAOYSA-N
MW436.52 g/mol
LogP2.43
Rot. Bonds7

About N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide

N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide (PubChem CID 91951592) has the molecular formula C23H28N6O3 and a molecular weight of 436.52 g/mol. Its IUPAC name is N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide.

Molecular Properties

Compound NameN-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
PubChem CID91951592
Molecular FormulaC23H28N6O3
Molecular Weight436.52 g/mol
Exact Mass436.22
IUPAC NameN-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
SMILESCC(C1CC1)n1nccc1NC(=O)CCn1c(=O)c(N2CCOCC2)nc2ccccc21
InChIInChI=1S/C23H28N6O3/c1-16(17-6-7-17)29-20(8-10-24-29)26-21(30)9-11-28-19-5-3-2-4-18(19)25-22(23(28)31)27-12-14-32-15-13-27/h2-5,8,10,16-17H,6-7,9,11-15H2,1H3,(H,26,30)
InChIKeyUQRSNNFOZILBNE-UHFFFAOYSA-N
XLogP2.43
TPSA94.28 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.52
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

3-(2-oxo-3-piperidin-1-ylquinoxalin-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 91951375
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-pyridin-4-ylpropanamide
CID 91951572
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-[1-(4-propan-2-ylphenyl)ethyl]propanamide
CID 91951503
N-ethyl-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951590
N-cyclohexyl-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951544
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(3-pyrazol-1-ylpropyl)propanamide
CID 91951498
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 91951582
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951530
N-(2-methyl-3-pyridinyl)-3-(2-oxo-3-piperidin-1-ylquinoxalin-1-yl)propanamide
CID 91951489
3-(2-oxo-3-pyrrolidin-1-ylquinoxalin-1-yl)-N-[1-(4-propan-2-ylphenyl)ethyl]propanamide
CID 91951168
3-(2-methylbenzimidazol-1-yl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide
CID 134706215
1-methyl-3-morpholin-4-ylquinoxalin-2-one
CID 146169023

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
The IUPAC name of N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide (CID 91951592) is N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide.
What is the SMILES notation for N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
The canonical SMILES for N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide is CC(C1CC1)n1nccc1NC(=O)CCn1c(=O)c(N2CCOCC2)nc2ccccc21.
What is the InChIKey of N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
The InChIKey is UQRSNNFOZILBNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N6O3/c1-16(17-6-7-17)29-20(8-10-24-29)26-21(30)9-11-28-19-5-3-2-4-18(19)25-22(23(28)31)27-12-14-32-15-13-27/h2-5,8,10,16-17H,6-7,9,11-15H2,1H3,(H,26,30).
What are the key properties of N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide has a molecular weight of 436.52 g/mol, XLogP of 2.43, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide is sourced from PubChem (CID 91951592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).