N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine

C20H23N5 — CID 155976483

IUPACN-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine
SMILESCc1nc2ccccc2nc1N1CCC(N(C)c2ccccn2)CC1
InChIInChI=1S/C20H23N5/c1-15-20(23-18-8-4-3-7-17(18)22-15)25-13-10-16(11-14-25)24(2)19-9-5-6-12-21-19/h3-9,12,16H,10-11,13-14H2,1-2H3
InChIKeyMWSGQXLNOMFRME-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.44
Rot. Bonds3

About N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine

N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine (PubChem CID 155976483) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine
PubChem CID155976483
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC NameN-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine
SMILESCc1nc2ccccc2nc1N1CCC(N(C)c2ccccn2)CC1
InChIInChI=1S/C20H23N5/c1-15-20(23-18-8-4-3-7-17(18)22-15)25-13-10-16(11-14-25)24(2)19-9-5-6-12-21-19/h3-9,12,16H,10-11,13-14H2,1-2H3
InChIKeyMWSGQXLNOMFRME-UHFFFAOYSA-N
XLogP3.44
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-N-methylpyridin-2-amine;hydrochloride
CID 69197423
N-cyclopropyl-6-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyrimidin-4-amine
CID 126890518
N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]-1,1-dioxo-1,2-benzothiazol-3-amine
CID 155799636
N-[1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]-N-methylpyridin-2-amine
CID 155975727
N-methyl-N-[1-(2-methylsulfanylpyrimidin-4-yl)piperidin-4-yl]pyridin-2-amine
CID 155975756
N-[1-(6-fluoroquinazolin-4-yl)piperidin-4-yl]-N-methylpyridin-2-amine
CID 155976434
N-methyl-N-[1-(4-methylsulfonylphenyl)piperidin-4-yl]pyridin-2-amine
CID 163344050
2-methyl-3-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]quinoxaline
CID 155981798
N-methyl-N-piperidin-4-ylpyridin-2-amine;hydrochloride
CID 71641470
N-methyl-N-[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-4-yl]pyridin-2-amine
CID 155975492
2-[4-(5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-3-methylquinoxaline
CID 139027361
2-methyl-3-(4-quinoxalin-2-ylpiperazin-1-yl)quinoxaline
CID 108776804

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine?
The IUPAC name of N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine (CID 155976483) is N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine.
What is the SMILES notation for N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine?
The canonical SMILES for N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine is Cc1nc2ccccc2nc1N1CCC(N(C)c2ccccn2)CC1.
What is the InChIKey of N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine?
The InChIKey is MWSGQXLNOMFRME-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5/c1-15-20(23-18-8-4-3-7-17(18)22-15)25-13-10-16(11-14-25)24(2)19-9-5-6-12-21-19/h3-9,12,16H,10-11,13-14H2,1-2H3.
What are the key properties of N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine?
N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine has a molecular weight of 333.44 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridin-2-amine is sourced from PubChem (CID 155976483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).