N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide

C19H24N4O2 — CID 167929276

IUPACN-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)cn1
InChIInChI=1S/C19H24N4O2/c1-14-12-21-18(13-20-14)19(25)22-16-4-2-15(3-5-16)6-9-23-10-7-17(24)8-11-23/h2-5,12-13,17,24H,6-11H2,1H3,(H,22,25)
InChIKeyKVPKLOKFBDLGRW-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.04
Rot. Bonds5

About N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide

N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide (PubChem CID 167929276) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide
PubChem CID167929276
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)cn1
InChIInChI=1S/C19H24N4O2/c1-14-12-21-18(13-20-14)19(25)22-16-4-2-15(3-5-16)6-9-23-10-7-17(24)8-11-23/h2-5,12-13,17,24H,6-11H2,1H3,(H,22,25)
InChIKeyKVPKLOKFBDLGRW-UHFFFAOYSA-N
XLogP2.04
TPSA78.35 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 ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide 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-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-2-methoxyacetamide
CID 71989273
N-[4-(azepan-1-yl)phenyl]-5-methylpyrazine-2-carboxamide
CID 51197527
N-(4-iodophenyl)-5-methylpyrazine-2-carboxamide
CID 2388228
3-cyano-N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]benzamide
CID 71869671
N-[4-(2-amino-2-hydroxyiminoethyl)phenyl]-5-methylpyrazine-2-carboxamide
CID 76938619
5-methyl-N-(4-phenylphenyl)pyrazine-2-carboxamide
CID 7926006
5-[(4-butylphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120684737
N-[4-(5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[4,3-a]azocin-3-yl)phenyl]-5-methylpyrazine-2-carboxamide
CID 17453593
5-methyl-N-[4-[[(2S)-oxolane-2-carbonyl]amino]phenyl]pyrazine-2-carboxamide
CID 37396639
5-methyl-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazine-2-carboxamide
CID 30548234
N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
CID 60575256
N-[4-(diethylcarbamoyl)phenyl]-5-methylpyrazine-2-carboxamide
CID 8503925

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide?
The IUPAC name of N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide (CID 167929276) is N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide?
The canonical SMILES for N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide is Cc1cnc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)cn1.
What is the InChIKey of N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide?
The InChIKey is KVPKLOKFBDLGRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-12-21-18(13-20-14)19(25)22-16-4-2-15(3-5-16)6-9-23-10-7-17(24)8-11-23/h2-5,12-13,17,24H,6-11H2,1H3,(H,22,25).
What are the key properties of N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide?
N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-hydroxypiperidin-1-yl)ethyl]phenyl]-5-methylpyrazine-2-carboxamide is sourced from PubChem (CID 167929276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).