1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol

C13H22N2O2 — CID 107153290

IUPAC1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol
SMILESCOc1cnc(C)cc1NCC(O)CC(C)C
InChIInChI=1S/C13H22N2O2/c1-9(2)5-11(16)7-15-12-6-10(3)14-8-13(12)17-4/h6,8-9,11,16H,5,7H2,1-4H3,(H,14,15)
InChIKeyLGBUUJBBVAHJRM-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.22
Rot. Bonds6

About 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol

1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol (PubChem CID 107153290) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol.

Molecular Properties

Compound Name1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol
PubChem CID107153290
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol
SMILESCOc1cnc(C)cc1NCC(O)CC(C)C
InChIInChI=1S/C13H22N2O2/c1-9(2)5-11(16)7-15-12-6-10(3)14-8-13(12)17-4/h6,8-9,11,16H,5,7H2,1-4H3,(H,14,15)
InChIKeyLGBUUJBBVAHJRM-UHFFFAOYSA-N
XLogP2.22
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol with MolForge

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Related Compounds

N-(5-methoxy-2-methyl-4-pyridinyl)-N',2-dimethylpropane-1,3-diamine
CID 106660920
5-methoxy-2-methyl-N-(2-methyl-3-methylsulfanylpropyl)pyridin-4-amine
CID 106660523
2-[(5-methoxy-2-methyl-4-pyridinyl)amino]-1-phenylethanol
CID 106660277
5-methoxy-2-methyl-N-prop-2-ynylpyridin-4-amine
CID 106660453
N-(5-methoxy-2-methyl-4-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 106660217
3-[(5-methoxy-2-methyl-4-pyridinyl)amino]propanamide
CID 106660291
N-benzyl-5-methoxy-2-methylpyridin-4-amine
CID 106660226
N-(cyclopentylmethyl)-5-methoxy-2-methylpyridin-4-amine
CID 106660273
N-(5-methoxy-2-methyl-4-pyridinyl)acetamide
CID 59938106
5-methoxy-2-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyridin-4-amine
CID 106660339
ethyl 3-[(5-methoxy-2-methyl-4-pyridinyl)amino]propanoate
CID 106660444
[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 106660625

Frequently Asked Questions

What is the IUPAC name of 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol?
The IUPAC name of 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol (CID 107153290) is 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol.
What is the SMILES notation for 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol?
The canonical SMILES for 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol is COc1cnc(C)cc1NCC(O)CC(C)C.
What is the InChIKey of 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol?
The InChIKey is LGBUUJBBVAHJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-9(2)5-11(16)7-15-12-6-10(3)14-8-13(12)17-4/h6,8-9,11,16H,5,7H2,1-4H3,(H,14,15).
What are the key properties of 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol?
1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol has a molecular weight of 238.33 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methoxy-2-methyl-4-pyridinyl)amino]-4-methylpentan-2-ol is sourced from PubChem (CID 107153290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).