N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide

C23H33N5O3 — CID 91951530

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
SMILESCN(C)C1(CNC(=O)CCn2c(=O)c(N3CCOCC3)nc3ccccc32)CCCC1
InChIInChI=1S/C23H33N5O3/c1-26(2)23(10-5-6-11-23)17-24-20(29)9-12-28-19-8-4-3-7-18(19)25-21(22(28)30)27-13-15-31-16-14-27/h3-4,7-8H,5-6,9-17H2,1-2H3,(H,24,29)
InChIKeyKRKLBYOZMNKJJO-UHFFFAOYSA-N
MW427.55 g/mol
LogP1.61
Rot. Bonds7

About N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide

N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide (PubChem CID 91951530) has the molecular formula C23H33N5O3 and a molecular weight of 427.55 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
PubChem CID91951530
Molecular FormulaC23H33N5O3
Molecular Weight427.55 g/mol
Exact Mass427.26
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
SMILESCN(C)C1(CNC(=O)CCn2c(=O)c(N3CCOCC3)nc3ccccc32)CCCC1
InChIInChI=1S/C23H33N5O3/c1-26(2)23(10-5-6-11-23)17-24-20(29)9-12-28-19-8-4-3-7-18(19)25-21(22(28)30)27-13-15-31-16-14-27/h3-4,7-8H,5-6,9-17H2,1-2H3,(H,24,29)
InChIKeyKRKLBYOZMNKJJO-UHFFFAOYSA-N
XLogP1.61
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.55
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

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-[1-(4-propan-2-ylphenyl)ethyl]propanamide
CID 91951503
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-(3-pyrazol-1-ylpropyl)propanamide
CID 91951498
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(2-oxo-3-piperidin-1-ylquinoxalin-1-yl)propanamide
CID 91951394
3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 91951582
N-(2-methoxyethyl)-3-(2-oxo-3-piperidin-1-ylquinoxalin-1-yl)propanamide
CID 91951418
N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951592
1-methyl-3-morpholin-4-ylquinoxalin-2-one
CID 146169023
1-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-3-piperidin-1-ylquinoxalin-2-one
CID 91951434
3-(2-oxo-3-pyrrolidin-1-ylquinoxalin-1-yl)-N-[1-(4-propan-2-ylphenyl)ethyl]propanamide
CID 91951168

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide (CID 91951530) is N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide is CN(C)C1(CNC(=O)CCn2c(=O)c(N3CCOCC3)nc3ccccc32)CCCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
The InChIKey is KRKLBYOZMNKJJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N5O3/c1-26(2)23(10-5-6-11-23)17-24-20(29)9-12-28-19-8-4-3-7-18(19)25-21(22(28)30)27-13-15-31-16-14-27/h3-4,7-8H,5-6,9-17H2,1-2H3,(H,24,29).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide?
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide has a molecular weight of 427.55 g/mol, XLogP of 1.61, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide is sourced from PubChem (CID 91951530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).