1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one

C14H24N2O — CID 115310323

IUPAC1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one
SMILESCc1cc(=O)cc(C)n1C(C)(CN)CC(C)C
InChIInChI=1S/C14H24N2O/c1-10(2)8-14(5,9-15)16-11(3)6-13(17)7-12(16)4/h6-7,10H,8-9,15H2,1-5H3
InChIKeyPQQCZSXISFRPMP-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.19
Rot. Bonds4

About 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one

1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one (PubChem CID 115310323) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one.

Molecular Properties

Compound Name1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one
PubChem CID115310323
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one
SMILESCc1cc(=O)cc(C)n1C(C)(CN)CC(C)C
InChIInChI=1S/C14H24N2O/c1-10(2)8-14(5,9-15)16-11(3)6-13(17)7-12(16)4/h6-7,10H,8-9,15H2,1-5H3
InChIKeyPQQCZSXISFRPMP-UHFFFAOYSA-N
XLogP2.19
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Amino-2-methylpropyl)-2,6-dimethylpyridin-4-one
CID 79001863
1-(1-Amino-4-methylpentan-2-yl)-2,6-dimethylpyridin-4-one
CID 79884850
1-[3-(Aminomethyl)pentan-3-yl]-2,6-dimethylpyridin-4-one
CID 79884851
1-[1-(Aminomethyl)cyclopentyl]-2,6-dimethylpyridin-4-one
CID 79884959
1-(2-Amino-3-methylbutyl)-2,6-dimethylpyridin-4-one
CID 79885169
1-(1-Amino-2-methylpropan-2-yl)-2,6-dimethylpyridin-4-one
CID 79885286
1-(2-Amino-1-cyclopropylethyl)-2,6-dimethylpyridin-4-one
CID 79885395
1-(1-Aminopentan-2-yl)-2,6-dimethylpyridin-4-one
CID 79885482
1-(1-Amino-3-methylbutan-2-yl)-2,6-dimethylpyridin-4-one
CID 79885483
1-(1-Aminohexan-2-yl)-2,6-dimethylpyridin-4-one
CID 80704082
1-[(1-Aminocyclobutyl)methyl]-2,6-dimethylpyridin-4-one
CID 103354314
1-[1-(Aminomethyl)-2-methylcyclohexyl]-2,6-dimethylpyridin-4-one
CID 113283756

Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one?
The IUPAC name of 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one (CID 115310323) is 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one.
What is the SMILES notation for 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one?
The canonical SMILES for 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one is Cc1cc(=O)cc(C)n1C(C)(CN)CC(C)C.
What is the InChIKey of 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one?
The InChIKey is PQQCZSXISFRPMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10(2)8-14(5,9-15)16-11(3)6-13(17)7-12(16)4/h6-7,10H,8-9,15H2,1-5H3.
What are the key properties of 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one?
1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one has a molecular weight of 236.36 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2,4-dimethylpentan-2-yl)-2,6-dimethylpyridin-4-one is sourced from PubChem (CID 115310323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).