(2R)-3-pyridin-3-ylbutan-2-ol

C9H13NO — CID 57231816

IUPAC(2R)-3-pyridin-3-ylbutan-2-ol
SMILESCC(c1cccnc1)[C@@H](C)O
InChIInChI=1S/C9H13NO/c1-7(8(2)11)9-4-3-5-10-6-9/h3-8,11H,1-2H3/t7?,8-/m1/s1
InChIKeyATDAXTAJBSDHSN-BRFYHDHCSA-N
MW151.21 g/mol
LogP1.57
Rot. Bonds2

About (2R)-3-pyridin-3-ylbutan-2-ol

(2R)-3-pyridin-3-ylbutan-2-ol (PubChem CID 57231816) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is (2R)-3-pyridin-3-ylbutan-2-ol.

Molecular Properties

Compound Name(2R)-3-pyridin-3-ylbutan-2-ol
PubChem CID57231816
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name(2R)-3-pyridin-3-ylbutan-2-ol
SMILESCC(c1cccnc1)[C@@H](C)O
InChIInChI=1S/C9H13NO/c1-7(8(2)11)9-4-3-5-10-6-9/h3-8,11H,1-2H3/t7?,8-/m1/s1
InChIKeyATDAXTAJBSDHSN-BRFYHDHCSA-N
XLogP1.57
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R)-3-pyridin-3-ylpent-4-en-2-ol
CID 134968632
3-(4-bromo-3-methylbutan-2-yl)pyridine
CID 83929749
2-amino-3-pyridin-3-ylbutanoic acid
CID 83906430
(1R)-1-pyridin-3-ylethanamine;hydrochloride
CID 53487230
3-[(1R)-1-phenylethyl]pyridine
CID 13287121
ethane;methane;3-propan-2-ylpyridine;sulfane
CID 159647027
3-[(1S)-1-chloroethyl]pyridine;hydrochloride
CID 171991541
1-hydroxy-1-pyridin-3-ylpropan-2-one
CID 12549519
2-(3-pyridin-3-ylbutan-2-yl)propane-1,3-diamine
CID 83929792
pyridin-3-yl(pyrimidin-2-yl)methanol
CID 54244340
3-(3,3-dimethylbutan-2-yl)pyridine
CID 59751404
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773

Frequently Asked Questions

What is the IUPAC name of (2R)-3-pyridin-3-ylbutan-2-ol?
The IUPAC name of (2R)-3-pyridin-3-ylbutan-2-ol (CID 57231816) is (2R)-3-pyridin-3-ylbutan-2-ol.
What is the SMILES notation for (2R)-3-pyridin-3-ylbutan-2-ol?
The canonical SMILES for (2R)-3-pyridin-3-ylbutan-2-ol is CC(c1cccnc1)[C@@H](C)O.
What is the InChIKey of (2R)-3-pyridin-3-ylbutan-2-ol?
The InChIKey is ATDAXTAJBSDHSN-BRFYHDHCSA-N. The full InChI is InChI=1S/C9H13NO/c1-7(8(2)11)9-4-3-5-10-6-9/h3-8,11H,1-2H3/t7?,8-/m1/s1.
What are the key properties of (2R)-3-pyridin-3-ylbutan-2-ol?
(2R)-3-pyridin-3-ylbutan-2-ol has a molecular weight of 151.21 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-pyridin-3-ylbutan-2-ol is sourced from PubChem (CID 57231816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).