3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide

C25H28N4O3 — CID 91951582

IUPAC3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
SMILESO=C(CCn1c(=O)c(N2CCOCC2)nc2ccccc21)NC1CCCc2ccccc21
InChIInChI=1S/C25H28N4O3/c30-23(26-20-10-5-7-18-6-1-2-8-19(18)20)12-13-29-22-11-4-3-9-21(22)27-24(25(29)31)28-14-16-32-17-15-28/h1-4,6,8-9,11,20H,5,7,10,12-17H2,(H,26,30)
InChIKeyDDSXZOBGJFAQIF-UHFFFAOYSA-N
MW432.52 g/mol
LogP2.82
Rot. Bonds5

About 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide

3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide (PubChem CID 91951582) has the molecular formula C25H28N4O3 and a molecular weight of 432.52 g/mol. Its IUPAC name is 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide.

Molecular Properties

Compound Name3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
PubChem CID91951582
Molecular FormulaC25H28N4O3
Molecular Weight432.52 g/mol
Exact Mass432.22
IUPAC Name3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
SMILESO=C(CCn1c(=O)c(N2CCOCC2)nc2ccccc21)NC1CCCc2ccccc21
InChIInChI=1S/C25H28N4O3/c30-23(26-20-10-5-7-18-6-1-2-8-19(18)20)12-13-29-22-11-4-3-9-21(22)27-24(25(29)31)28-14-16-32-17-15-28/h1-4,6,8-9,11,20H,5,7,10,12-17H2,(H,26,30)
InChIKeyDDSXZOBGJFAQIF-UHFFFAOYSA-N
XLogP2.82
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.52
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclohexyl-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951544
N-ethyl-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951590
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951530
N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951592
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-[1-(4-propan-2-ylphenyl)ethyl]propanamide
CID 91951503
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(3-pyrazol-1-ylpropyl)propanamide
CID 91951498
3-(4-hydroxypiperidin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 110882834
4-(2-oxo-1,3-benzoxazol-3-yl)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]butanamide
CID 2477104
(2R)-1-[3-oxo-3-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propyl]pyrrolidine-2-carboxylic acid
CID 124703488
(2S)-1-[3-oxo-3-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propyl]pyrrolidine-2-carboxylic acid
CID 125118742
1-[(2-morpholin-4-yl-3-pyridinyl)methyl]-3-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]urea
CID 30867258
2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 7224491

Frequently Asked Questions

What is the IUPAC name of 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?
The IUPAC name of 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide (CID 91951582) is 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide.
What is the SMILES notation for 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?
The canonical SMILES for 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide is O=C(CCn1c(=O)c(N2CCOCC2)nc2ccccc21)NC1CCCc2ccccc21.
What is the InChIKey of 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?
The InChIKey is DDSXZOBGJFAQIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O3/c30-23(26-20-10-5-7-18-6-1-2-8-19(18)20)12-13-29-22-11-4-3-9-21(22)27-24(25(29)31)28-14-16-32-17-15-28/h1-4,6,8-9,11,20H,5,7,10,12-17H2,(H,26,30).
What are the key properties of 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide has a molecular weight of 432.52 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide is sourced from PubChem (CID 91951582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).