(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol

C15H18N2O — CID 124501345

IUPAC(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol
SMILESCC[C@@H](O)c1cnc(Nc2ccccc2)c(C)c1
InChIInChI=1S/C15H18N2O/c1-3-14(18)12-9-11(2)15(16-10-12)17-13-7-5-4-6-8-13/h4-10,14,18H,3H2,1-2H3,(H,16,17)/t14-/m1/s1
InChIKeyZAFWPLJTZIIPHS-CQSZACIVSA-N
MW242.32 g/mol
LogP3.58
Rot. Bonds4

About (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol

(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol (PubChem CID 124501345) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol.

Molecular Properties

Compound Name(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol
PubChem CID124501345
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol
SMILESCC[C@@H](O)c1cnc(Nc2ccccc2)c(C)c1
InChIInChI=1S/C15H18N2O/c1-3-14(18)12-9-11(2)15(16-10-12)17-13-7-5-4-6-8-13/h4-10,14,18H,3H2,1-2H3,(H,16,17)/t14-/m1/s1
InChIKeyZAFWPLJTZIIPHS-CQSZACIVSA-N
XLogP3.58
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(6-anilino-3-pyridinyl)propan-1-ol
CID 124502835
1-[6-(cyclopropylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 102545010
(1R)-1-(5-methyl-6-phenylmethoxy-3-pyridinyl)propan-1-ol
CID 124501397
(1R)-1-(6-iodo-5-methyl-3-pyridinyl)propan-1-ol
CID 124503154
(S)-[5-methyl-6-(methylamino)-3-pyridinyl]-phenylmethanol
CID 124501220
1-[6-[5-(1-hydroxypropyl)-2-pyridinyl]-3-pyridinyl]propan-1-ol
CID 10849809
(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 124501319
1-(6-tert-butylsulfanyl-5-methyl-3-pyridinyl)propan-1-ol
CID 102545043
(1R)-1-[6-(dipropylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 124501331
1-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-3-pyridinyl]propan-1-ol
CID 102545058
1-phenylpropan-1-ol;hydrate
CID 156782934
(1R)-1-[6-(3,4-dihydro-2H-quinolin-1-yl)-5-methyl-3-pyridinyl]propan-1-ol
CID 124501642

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol?
The IUPAC name of (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol (CID 124501345) is (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol.
What is the SMILES notation for (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol?
The canonical SMILES for (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol is CC[C@@H](O)c1cnc(Nc2ccccc2)c(C)c1.
What is the InChIKey of (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol?
The InChIKey is ZAFWPLJTZIIPHS-CQSZACIVSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-14(18)12-9-11(2)15(16-10-12)17-13-7-5-4-6-8-13/h4-10,14,18H,3H2,1-2H3,(H,16,17)/t14-/m1/s1.
What are the key properties of (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol?
(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol has a molecular weight of 242.32 g/mol, XLogP of 3.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol is sourced from PubChem (CID 124501345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).