6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one

C15H26N2O — CID 62565839

IUPAC6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one
SMILESCc1cccc(=O)n1CCNC(C)CCC(C)C
InChIInChI=1S/C15H26N2O/c1-12(2)8-9-13(3)16-10-11-17-14(4)6-5-7-15(17)18/h5-7,12-13,16H,8-11H2,1-4H3
InChIKeyUZVOJOUJXCWGDH-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.57
Rot. Bonds7

About 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one

6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one (PubChem CID 62565839) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one.

Molecular Properties

Compound Name6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one
PubChem CID62565839
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one
SMILESCc1cccc(=O)n1CCNC(C)CCC(C)C
InChIInChI=1S/C15H26N2O/c1-12(2)8-9-13(3)16-10-11-17-14(4)6-5-7-15(17)18/h5-7,12-13,16H,8-11H2,1-4H3
InChIKeyUZVOJOUJXCWGDH-UHFFFAOYSA-N
XLogP2.57
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one?
The IUPAC name of 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one (CID 62565839) is 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one.
What is the SMILES notation for 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one?
The canonical SMILES for 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one is Cc1cccc(=O)n1CCNC(C)CCC(C)C.
What is the InChIKey of 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one?
The InChIKey is UZVOJOUJXCWGDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(2)8-9-13(3)16-10-11-17-14(4)6-5-7-15(17)18/h5-7,12-13,16H,8-11H2,1-4H3.
What are the key properties of 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one?
6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one has a molecular weight of 250.39 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-[2-(5-methylhexan-2-ylamino)ethyl]pyridin-2-one is sourced from PubChem (CID 62565839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).