(2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol

C9H14N2O — CID 130987369

IUPAC(2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol
SMILESCc1cncc([C@@](C)(N)CO)c1
InChIInChI=1S/C9H14N2O/c1-7-3-8(5-11-4-7)9(2,10)6-12/h3-5,12H,6,10H2,1-2H3/t9-/m0/s1
InChIKeyHFTFNPUZLXNRND-VIFPVBQESA-N
MW166.22 g/mol
LogP0.56
Rot. Bonds2

About (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol

(2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol (PubChem CID 130987369) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol.

Molecular Properties

Compound Name(2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol
PubChem CID130987369
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name(2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol
SMILESCc1cncc([C@@](C)(N)CO)c1
InChIInChI=1S/C9H14N2O/c1-7-3-8(5-11-4-7)9(2,10)6-12/h3-5,12H,6,10H2,1-2H3/t9-/m0/s1
InChIKeyHFTFNPUZLXNRND-VIFPVBQESA-N
XLogP0.56
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol?
The IUPAC name of (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol (CID 130987369) is (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol.
What is the SMILES notation for (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol?
The canonical SMILES for (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol is Cc1cncc([C@@](C)(N)CO)c1.
What is the InChIKey of (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol?
The InChIKey is HFTFNPUZLXNRND-VIFPVBQESA-N. The full InChI is InChI=1S/C9H14N2O/c1-7-3-8(5-11-4-7)9(2,10)6-12/h3-5,12H,6,10H2,1-2H3/t9-/m0/s1.
What are the key properties of (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol?
(2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol has a molecular weight of 166.22 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(5-methyl-3-pyridinyl)propan-1-ol is sourced from PubChem (CID 130987369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).