N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide

C19H23N5O2 — CID 109230186

IUPACN-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2cncc(C(=O)N3CCN(C)CC3)c2)cc1
InChIInChI=1S/C19H23N5O2/c1-14(25)21-16-3-5-17(6-4-16)22-18-11-15(12-20-13-18)19(26)24-9-7-23(2)8-10-24/h3-6,11-13,22H,7-10H2,1-2H3,(H,21,25)
InChIKeyKFHXJRFTQQRXKN-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.17
Rot. Bonds4

About N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide

N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide (PubChem CID 109230186) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
PubChem CID109230186
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC NameN-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2cncc(C(=O)N3CCN(C)CC3)c2)cc1
InChIInChI=1S/C19H23N5O2/c1-14(25)21-16-3-5-17(6-4-16)22-18-11-15(12-20-13-18)19(26)24-9-7-23(2)8-10-24/h3-6,11-13,22H,7-10H2,1-2H3,(H,21,25)
InChIKeyKFHXJRFTQQRXKN-UHFFFAOYSA-N
XLogP2.17
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide 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-[[5-(pyrrolidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
CID 109225638
[5-(3,4-dichloroanilino)-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109230218
(4-methylpiperazin-1-yl)-[5-[4-(4-methylpiperazin-1-yl)anilino]-3-pyridinyl]methanone
CID 109230198
N-[4-[[5-(4-methylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
CID 109227130
[5-(3,4-difluoroanilino)-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109230234
1-[4-[5-(4-chloroanilino)pyridine-3-carbonyl]piperazin-1-yl]ethanone
CID 109231098
1-[4-[5-[4-(dimethylamino)anilino]pyridine-3-carbonyl]piperazin-1-yl]ethanone
CID 109231128
[5-(2,6-dichloroanilino)-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109230222
[5-(2,4-dimethylanilino)-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109230137
N-(4-acetamidophenyl)-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102613
methyl 4-[[5-(4-methylpiperazine-1-carbonyl)pyridine-3-carbonyl]amino]benzoate
CID 109104507
(4-methylpiperazin-1-yl)-[5-[2-(trifluoromethyl)anilino]-3-pyridinyl]methanone
CID 109230180

Frequently Asked Questions

What is the IUPAC name of N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
The IUPAC name of N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide (CID 109230186) is N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide.
What is the SMILES notation for N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
The canonical SMILES for N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide is CC(=O)Nc1ccc(Nc2cncc(C(=O)N3CCN(C)CC3)c2)cc1.
What is the InChIKey of N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
The InChIKey is KFHXJRFTQQRXKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-14(25)21-16-3-5-17(6-4-16)22-18-11-15(12-20-13-18)19(26)24-9-7-23(2)8-10-24/h3-6,11-13,22H,7-10H2,1-2H3,(H,21,25).
What are the key properties of N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide has a molecular weight of 353.43 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide is sourced from PubChem (CID 109230186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).