N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide

C14H20N4O2 — CID 112530383

IUPACN-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide
SMILESCC(=O)NCc1cc(C(=O)N2CCN(C)CC2)ccn1
InChIInChI=1S/C14H20N4O2/c1-11(19)16-10-13-9-12(3-4-15-13)14(20)18-7-5-17(2)6-8-18/h3-4,9H,5-8,10H2,1-2H3,(H,16,19)
InChIKeyYSJHRPBSWSALEP-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.11
Rot. Bonds3

About N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide

N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide (PubChem CID 112530383) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide
PubChem CID112530383
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide
SMILESCC(=O)NCc1cc(C(=O)N2CCN(C)CC2)ccn1
InChIInChI=1S/C14H20N4O2/c1-11(19)16-10-13-9-12(3-4-15-13)14(20)18-7-5-17(2)6-8-18/h3-4,9H,5-8,10H2,1-2H3,(H,16,19)
InChIKeyYSJHRPBSWSALEP-UHFFFAOYSA-N
XLogP0.11
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]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-(azepane-1-carbonyl)-2-pyridinyl]methyl]acetamide
CID 112530487
N-[[4-[4-(hydroxymethyl)piperidine-1-carbonyl]-2-pyridinyl]methyl]acetamide
CID 112531754
N-[[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-pyridinyl]methyl]acetamide
CID 112531337
2-[[(2-acetamidoacetyl)amino]methyl]pyridine-4-carboxylic acid
CID 113277490
N-[[4-(2-methyl-2,3-dihydroindole-1-carbonyl)-2-pyridinyl]methyl]acetamide
CID 112532256
ethyl N-[[4-(piperidine-1-carbonyl)-2-pyridinyl]methyl]carbamate
CID 112530420
5-(4-methylpiperazine-1-carbonyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 109104414
(2-methoxy-4-pyridinyl)-(4-methylpiperazin-1-yl)methanone
CID 110849835
(2-tert-butyl-4-pyridinyl)-(4-methylpiperazin-1-yl)methanone
CID 4731355
N-[(4-methyl-2-pyridinyl)methyl]acetamide
CID 121378939
N-[(4-fluorophenyl)methyl]-4-(4-methylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084148
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109084137

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide?
The IUPAC name of N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide (CID 112530383) is N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide.
What is the SMILES notation for N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide?
The canonical SMILES for N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide is CC(=O)NCc1cc(C(=O)N2CCN(C)CC2)ccn1.
What is the InChIKey of N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide?
The InChIKey is YSJHRPBSWSALEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-11(19)16-10-13-9-12(3-4-15-13)14(20)18-7-5-17(2)6-8-18/h3-4,9H,5-8,10H2,1-2H3,(H,16,19).
What are the key properties of N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide?
N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide has a molecular weight of 276.34 g/mol, XLogP of 0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]methyl]acetamide is sourced from PubChem (CID 112530383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).