(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol

C13H22N2O — CID 124501319

IUPAC(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol
SMILESCC[C@@H](O)c1cnc(N(CC)CC)c(C)c1
InChIInChI=1S/C13H22N2O/c1-5-12(16)11-8-10(4)13(14-9-11)15(6-2)7-3/h8-9,12,16H,5-7H2,1-4H3/t12-/m1/s1
InChIKeySEEKYTXUNHVKLY-GFCCVEGCSA-N
MW222.33 g/mol
LogP2.68
Rot. Bonds5

About (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol

(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol (PubChem CID 124501319) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol
PubChem CID124501319
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol
SMILESCC[C@@H](O)c1cnc(N(CC)CC)c(C)c1
InChIInChI=1S/C13H22N2O/c1-5-12(16)11-8-10(4)13(14-9-11)15(6-2)7-3/h8-9,12,16H,5-7H2,1-4H3/t12-/m1/s1
InChIKeySEEKYTXUNHVKLY-GFCCVEGCSA-N
XLogP2.68
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[6-(dipropylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 124501331
(1R)-1-(6-iodo-5-methyl-3-pyridinyl)propan-1-ol
CID 124503154
5-ethenyl-N,N-diethyl-3-methylpyridin-2-amine
CID 102544679
1-(6-tert-butylsulfanyl-5-methyl-3-pyridinyl)propan-1-ol
CID 102545043
1-[6-[5-(1-hydroxypropyl)-2-pyridinyl]-3-pyridinyl]propan-1-ol
CID 10849809
1-[6-(cyclopropylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 102545010
(1R)-1-(6-anilino-5-methyl-3-pyridinyl)propan-1-ol
CID 124501345
(1R)-1-[6-(dimethylamino)-5-methyl-3-pyridinyl]ethanol
CID 124501239
(1R)-1-(5-methyl-6-phenylmethoxy-3-pyridinyl)propan-1-ol
CID 124501397
5-[(1S)-1-aminoethyl]-N-ethyl-N,3-dimethylpyridin-2-amine
CID 124501310
1-(5,6-dimethyl-3-pyridinyl)butan-1-ol
CID 130560260
(1R)-1-[5-methyl-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]propan-1-ol
CID 124501540

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol?
The IUPAC name of (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol (CID 124501319) is (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol?
The canonical SMILES for (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol is CC[C@@H](O)c1cnc(N(CC)CC)c(C)c1.
What is the InChIKey of (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol?
The InChIKey is SEEKYTXUNHVKLY-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H22N2O/c1-5-12(16)11-8-10(4)13(14-9-11)15(6-2)7-3/h8-9,12,16H,5-7H2,1-4H3/t12-/m1/s1.
What are the key properties of (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol?
(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol has a molecular weight of 222.33 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol is sourced from PubChem (CID 124501319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).