6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol

C12H20N2O — CID 64515366

IUPAC6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol
SMILESCC(C)C(O)CCCc1cnccc1N
InChIInChI=1S/C12H20N2O/c1-9(2)12(15)5-3-4-10-8-14-7-6-11(10)13/h6-9,12,15H,3-5H2,1-2H3,(H2,13,14)
InChIKeyUGBHLXYCPSNAOF-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.00
Rot. Bonds5

About 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol

6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol (PubChem CID 64515366) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol.

Molecular Properties

Compound Name6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol
PubChem CID64515366
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol
SMILESCC(C)C(O)CCCc1cnccc1N
InChIInChI=1S/C12H20N2O/c1-9(2)12(15)5-3-4-10-8-14-7-6-11(10)13/h6-9,12,15H,3-5H2,1-2H3,(H2,13,14)
InChIKeyUGBHLXYCPSNAOF-UHFFFAOYSA-N
XLogP2.00
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluoro-4-pyridinyl)-4-methylpentan-3-ol
CID 104739077
3-(5-methoxypentyl)pyridin-4-amine
CID 104649837
2-(4-amino-3-pyridinyl)-1-(3-methylfuran-2-yl)ethanol
CID 104800650
4-(4-amino-3-pyridinyl)butan-2-one
CID 64522504
3-(2-hydrazinyl-3-methylbutyl)pyridin-4-amine
CID 105199730
3-(2-chlorobutyl)pyridin-4-amine
CID 130480258
1-(4-amino-3-pyridinyl)-3-ethylpentane-2,3-diol
CID 103449230
3-(bromomethyl)pyridin-4-amine
CID 18674607
3-[3-(3-methoxypropoxy)propyl]pyridin-4-amine
CID 103184229
3-(4-methoxy-4-methylpentyl)pyridin-4-amine
CID 103037376
3-(4-amino-3-pyridinyl)-1-methoxy-1-phenylpropan-2-ol
CID 116756787
3-(4-amino-3-pyridinyl)-1-cyclopropyl-1-methoxypropan-2-ol
CID 116712449

Frequently Asked Questions

What is the IUPAC name of 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol?
The IUPAC name of 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol (CID 64515366) is 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol.
What is the SMILES notation for 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol?
The canonical SMILES for 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol is CC(C)C(O)CCCc1cnccc1N.
What is the InChIKey of 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol?
The InChIKey is UGBHLXYCPSNAOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-9(2)12(15)5-3-4-10-8-14-7-6-11(10)13/h6-9,12,15H,3-5H2,1-2H3,(H2,13,14).
What are the key properties of 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol?
6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol has a molecular weight of 208.31 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-amino-3-pyridinyl)-2-methylhexan-3-ol is sourced from PubChem (CID 64515366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).