N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine

C19H25N5 — CID 167779946

IUPACN-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine
SMILESCc1cccc(N2CCC(NC3CCCc4nccnc43)CC2)n1
InChIInChI=1S/C19H25N5/c1-14-4-2-7-18(22-14)24-12-8-15(9-13-24)23-17-6-3-5-16-19(17)21-11-10-20-16/h2,4,7,10-11,15,17,23H,3,5-6,8-9,12-13H2,1H3
InChIKeyLQGVJXHFVGWKMB-UHFFFAOYSA-N
MW323.44 g/mol
LogP2.82
Rot. Bonds3

About N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine

N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine (PubChem CID 167779946) has the molecular formula C19H25N5 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine.

Molecular Properties

Compound NameN-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine
PubChem CID167779946
Molecular FormulaC19H25N5
Molecular Weight323.44 g/mol
Exact Mass323.21
IUPAC NameN-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine
SMILESCc1cccc(N2CCC(NC3CCCc4nccnc43)CC2)n1
InChIInChI=1S/C19H25N5/c1-14-4-2-7-18(22-14)24-12-8-15(9-13-24)23-17-6-3-5-16-19(17)21-11-10-20-16/h2,4,7,10-11,15,17,23H,3,5-6,8-9,12-13H2,1H3
InChIKeyLQGVJXHFVGWKMB-UHFFFAOYSA-N
XLogP2.82
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine?
The IUPAC name of N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine (CID 167779946) is N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine.
What is the SMILES notation for N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine?
The canonical SMILES for N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine is Cc1cccc(N2CCC(NC3CCCc4nccnc43)CC2)n1.
What is the InChIKey of N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine?
The InChIKey is LQGVJXHFVGWKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5/c1-14-4-2-7-18(22-14)24-12-8-15(9-13-24)23-17-6-3-5-16-19(17)21-11-10-20-16/h2,4,7,10-11,15,17,23H,3,5-6,8-9,12-13H2,1H3.
What are the key properties of N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine?
N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine has a molecular weight of 323.44 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-5,6,7,8-tetrahydroquinoxalin-5-amine is sourced from PubChem (CID 167779946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).