N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide

C19H24N4O2 — CID 117093223

IUPACN-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide
SMILESCN1CCN(c2ccc(-c3cc(C(=O)NCCO)ccn3)cc2)CC1
InChIInChI=1S/C19H24N4O2/c1-22-9-11-23(12-10-22)17-4-2-15(3-5-17)18-14-16(6-7-20-18)19(25)21-8-13-24/h2-7,14,24H,8-13H2,1H3,(H,21,25)
InChIKeyLTAOPTDYEIAQDW-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.22
Rot. Bonds5

About N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide

N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide (PubChem CID 117093223) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide
PubChem CID117093223
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide
SMILESCN1CCN(c2ccc(-c3cc(C(=O)NCCO)ccn3)cc2)CC1
InChIInChI=1S/C19H24N4O2/c1-22-9-11-23(12-10-22)17-4-2-15(3-5-17)18-14-16(6-7-20-18)19(25)21-8-13-24/h2-7,14,24H,8-13H2,1H3,(H,21,25)
InChIKeyLTAOPTDYEIAQDW-UHFFFAOYSA-N
XLogP1.22
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(4-phenoxyphenyl)pyridine-4-carboxamide
CID 117091054
N-[2-[di(propan-2-yl)amino]ethyl]-2-[4-(4-methylpiperazine-1-carbonyl)phenyl]pyridine-4-carboxamide
CID 117094329
N-[2-(dimethylamino)ethyl]-2-[4-(4-methylpiperazin-1-yl)anilino]pyridine-4-carboxamide
CID 109167751
N-propyl-2-[4-(propylcarbamoyl)-2-pyridinyl]pyridine-4-carboxamide
CID 57050532
2-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-N-(2-methylpropyl)pyridine-2,4-dicarboxamide
CID 109079711
N-[(3R)-3-methoxybutyl]-2-(4-methylpiperazin-1-yl)pyridine-4-carboxamide
CID 97212701
N-(2-morpholin-4-ylethyl)-2-(6-morpholin-4-yl-3-pyridinyl)pyridine-4-carboxamide
CID 117093186
3,4-dimethyl-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]benzamide
CID 16889269
2-[4-(cyclopropylcarbamoyl)phenyl]-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 117088266
N-[2-(4-aminophenyl)ethyl]-2-(4-methylpiperazin-1-yl)pyridine-4-carboxamide;dihydrochloride
CID 119549443
2-N,2-N-diethyl-4-N-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-2,4-dicarboxamide
CID 109088980
3,4-dichloro-N-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]benzamide
CID 16889710

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide (CID 117093223) is N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide is CN1CCN(c2ccc(-c3cc(C(=O)NCCO)ccn3)cc2)CC1.
What is the InChIKey of N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide?
The InChIKey is LTAOPTDYEIAQDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22-9-11-23(12-10-22)17-4-2-15(3-5-17)18-14-16(6-7-20-18)19(25)21-8-13-24/h2-7,14,24H,8-13H2,1H3,(H,21,25).
What are the key properties of N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide?
N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 117093223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).