N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide

C19H22N4O2 — CID 109084332

IUPACN-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide
SMILESCN1CCN(C(=O)c2cc(C(=O)N(C)c3ccccc3)ccn2)CC1
InChIInChI=1S/C19H22N4O2/c1-21-10-12-23(13-11-21)19(25)17-14-15(8-9-20-17)18(24)22(2)16-6-4-3-5-7-16/h3-9,14H,10-13H2,1-2H3
InChIKeyYWVUAWVBPRVXAY-UHFFFAOYSA-N
MW338.41 g/mol
LogP1.75
Rot. Bonds3

About N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide

N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide (PubChem CID 109084332) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide
PubChem CID109084332
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC NameN-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide
SMILESCN1CCN(C(=O)c2cc(C(=O)N(C)c3ccccc3)ccn2)CC1
InChIInChI=1S/C19H22N4O2/c1-21-10-12-23(13-11-21)19(25)17-14-15(8-9-20-17)18(24)22(2)16-6-4-3-5-7-16/h3-9,14H,10-13H2,1-2H3
InChIKeyYWVUAWVBPRVXAY-UHFFFAOYSA-N
XLogP1.75
TPSA56.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-diethyl-2-(4-methylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084314
N-[4-(dimethylamino)phenyl]-2-(4-methylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084386
2-(4-methylpiperazine-1-carbonyl)-N,N-dipropylpyridine-4-carboxamide
CID 109084325
[4-(N-ethylanilino)-2-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109208139
N-ethyl-2-(4-formylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide
CID 109084799
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109084137
N-benzyl-N-methyl-2-(pyrrolidine-1-carbonyl)pyridine-4-carboxamide
CID 109080522
4-[methyl-(4-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730175
N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081326
4-[methyl-(3-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730189
4-N-methyl-4-N-phenyl-2-N-propylpyridine-2,4-dicarboxamide
CID 109077905
N-(4-chlorophenyl)-2-(4-methylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084356

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide?
The IUPAC name of N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide (CID 109084332) is N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide.
What is the SMILES notation for N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide?
The canonical SMILES for N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide is CN1CCN(C(=O)c2cc(C(=O)N(C)c3ccccc3)ccn2)CC1.
What is the InChIKey of N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide?
The InChIKey is YWVUAWVBPRVXAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-21-10-12-23(13-11-21)19(25)17-14-15(8-9-20-17)18(24)22(2)16-6-4-3-5-7-16/h3-9,14H,10-13H2,1-2H3.
What are the key properties of N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide?
N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide is sourced from PubChem (CID 109084332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).