1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine

C21H24N4 — CID 11115050

IUPAC1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine
SMILESCc1cccc(CN(Cc2cccc(C)n2)Cc2cccc(C)n2)n1
InChIInChI=1S/C21H24N4/c1-16-7-4-10-19(22-16)13-25(14-20-11-5-8-17(2)23-20)15-21-12-6-9-18(3)24-21/h4-12H,13-15H2,1-3H3
InChIKeyUUIBFVHQGDVISE-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.00
Rot. Bonds6

About 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine

1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine (PubChem CID 11115050) has the molecular formula C21H24N4 and a molecular weight of 332.45 g/mol. Its IUPAC name is 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine.

Molecular Properties

Compound Name1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine
PubChem CID11115050
Molecular FormulaC21H24N4
Molecular Weight332.45 g/mol
Exact Mass332.20
IUPAC Name1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine
SMILESCc1cccc(CN(Cc2cccc(C)n2)Cc2cccc(C)n2)n1
InChIInChI=1S/C21H24N4/c1-16-7-4-10-19(22-16)13-25(14-20-11-5-8-17(2)23-20)15-21-12-6-9-18(3)24-21/h4-12H,13-15H2,1-3H3
InChIKeyUUIBFVHQGDVISE-UHFFFAOYSA-N
XLogP4.00
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine?
The IUPAC name of 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine (CID 11115050) is 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine.
What is the SMILES notation for 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine?
The canonical SMILES for 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine is Cc1cccc(CN(Cc2cccc(C)n2)Cc2cccc(C)n2)n1.
What is the InChIKey of 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine?
The InChIKey is UUIBFVHQGDVISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4/c1-16-7-4-10-19(22-16)13-25(14-20-11-5-8-17(2)23-20)15-21-12-6-9-18(3)24-21/h4-12H,13-15H2,1-3H3.
What are the key properties of 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine?
1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine has a molecular weight of 332.45 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-2-pyridinyl)-N,N-bis[(6-methyl-2-pyridinyl)methyl]methanamine is sourced from PubChem (CID 11115050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).