N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide

C25H30ClN5O4 — CID 10255405

IUPACN-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
SMILESO=C(CC(CN1CCOCC1)NC(=O)c1ccc(N2CCCCC2=O)cc1)Nc1ccc(Cl)cn1
InChIInChI=1S/C25H30ClN5O4/c26-19-6-9-22(27-16-19)29-23(32)15-20(17-30-11-13-35-14-12-30)28-25(34)18-4-7-21(8-5-18)31-10-2-1-3-24(31)33/h4-9,16,20H,1-3,10-15,17H2,(H,28,34)(H,27,29,32)
InChIKeyROAZTVSYUKBDOU-UHFFFAOYSA-N
MW500.00 g/mol
LogP2.71
Rot. Bonds8

About N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide

N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide (PubChem CID 10255405) has the molecular formula C25H30ClN5O4 and a molecular weight of 500.00 g/mol. Its IUPAC name is N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
PubChem CID10255405
Molecular FormulaC25H30ClN5O4
Molecular Weight500.00 g/mol
Exact Mass499.20
IUPAC NameN-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
SMILESO=C(CC(CN1CCOCC1)NC(=O)c1ccc(N2CCCCC2=O)cc1)Nc1ccc(Cl)cn1
InChIInChI=1S/C25H30ClN5O4/c26-19-6-9-22(27-16-19)29-23(32)15-20(17-30-11-13-35-14-12-30)28-25(34)18-4-7-21(8-5-18)31-10-2-1-3-24(31)33/h4-9,16,20H,1-3,10-15,17H2,(H,28,34)(H,27,29,32)
InChIKeyROAZTVSYUKBDOU-UHFFFAOYSA-N
XLogP2.71
TPSA103.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500500.00
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(4-chloroanilino)-1-(2-morpholin-4-ylethoxy)-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 69440917
N-[4-(4-chloroanilino)-4-oxo-1-phenylbutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 69441854
5-chloro-N-(5-chloro-2-pyridinyl)-3-methoxy-2-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]benzamide
CID 10185995
N-[4-(4-chloroanilino)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethoxy]-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 69441450
N-[4-(4-chloroanilino)-1-[2-(1,1-dihydroxy-1,4-thiazinan-4-yl)ethoxy]-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 69441451
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 52509086
N-[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide
CID 52509087
N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322
4-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethoxy]-N-morpholin-4-ylbenzamide
CID 141108855
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24595498
N'-[2-(4-chlorophenyl)acetyl]-4-(2-oxopyrrolidin-1-yl)benzohydrazide
CID 26657735
4-(2-oxopyrrolidin-1-yl)-N-propan-2-ylbenzamide
CID 6621975

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
The IUPAC name of N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide (CID 10255405) is N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide.
What is the SMILES notation for N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
The canonical SMILES for N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide is O=C(CC(CN1CCOCC1)NC(=O)c1ccc(N2CCCCC2=O)cc1)Nc1ccc(Cl)cn1.
What is the InChIKey of N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
The InChIKey is ROAZTVSYUKBDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30ClN5O4/c26-19-6-9-22(27-16-19)29-23(32)15-20(17-30-11-13-35-14-12-30)28-25(34)18-4-7-21(8-5-18)31-10-2-1-3-24(31)33/h4-9,16,20H,1-3,10-15,17H2,(H,28,34)(H,27,29,32).
What are the key properties of N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide?
N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide has a molecular weight of 500.00 g/mol, XLogP of 2.71, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-chloro-2-pyridinyl)amino]-1-morpholin-4-yl-4-oxobutan-2-yl]-4-(2-oxopiperidin-1-yl)benzamide is sourced from PubChem (CID 10255405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).