4-[(2S)-pentan-2-yl]pyridine

C10H15N — CID 166675231

IUPAC4-[(2S)-pentan-2-yl]pyridine
SMILESCCC[C@H](C)c1ccncc1
InChIInChI=1S/C10H15N/c1-3-4-9(2)10-5-7-11-8-6-10/h5-9H,3-4H2,1-2H3/t9-/m0/s1
InChIKeyZVXQINUALXERIW-VIFPVBQESA-N
MW149.24 g/mol
LogP2.99
Rot. Bonds3

About 4-[(2S)-pentan-2-yl]pyridine

4-[(2S)-pentan-2-yl]pyridine (PubChem CID 166675231) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 4-[(2S)-pentan-2-yl]pyridine.

Molecular Properties

Compound Name4-[(2S)-pentan-2-yl]pyridine
PubChem CID166675231
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name4-[(2S)-pentan-2-yl]pyridine
SMILESCCC[C@H](C)c1ccncc1
InChIInChI=1S/C10H15N/c1-3-4-9(2)10-5-7-11-8-6-10/h5-9H,3-4H2,1-2H3/t9-/m0/s1
InChIKeyZVXQINUALXERIW-VIFPVBQESA-N
XLogP2.99
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

pentan-2-ylbenzene
CID 17627
2-pyridin-4-ylpropane-1-thiol
CID 146504798
N-[(1R)-1-pyridin-4-ylethyl]heptan-4-amine
CID 28644656
4-(1-ethyl-3-pyridin-4-ylbutyl)pyridine
CID 18346387
N-ethyl-2-methyl-1-pyridin-4-ylpentan-1-amine
CID 107893389
4-[(5S,6S)-6-pyridin-4-yldecan-5-yl]pyridine
CID 125129263
4-pyridin-4-ylpentan-2-amine
CID 112714269
2-methoxy-4-pentan-2-ylpyridine
CID 155069578
3-(4-pyridin-4-ylphenyl)butan-1-amine
CID 82542949
N-methyl-2-pyridin-4-ylpentan-1-amine
CID 116824893
3-methyl-4-pentan-2-ylpyridine
CID 143325066
1-(chloromethyl)-4-pentan-2-ylbenzene
CID 19353579

Frequently Asked Questions

What is the IUPAC name of 4-[(2S)-pentan-2-yl]pyridine?
The IUPAC name of 4-[(2S)-pentan-2-yl]pyridine (CID 166675231) is 4-[(2S)-pentan-2-yl]pyridine.
What is the SMILES notation for 4-[(2S)-pentan-2-yl]pyridine?
The canonical SMILES for 4-[(2S)-pentan-2-yl]pyridine is CCC[C@H](C)c1ccncc1.
What is the InChIKey of 4-[(2S)-pentan-2-yl]pyridine?
The InChIKey is ZVXQINUALXERIW-VIFPVBQESA-N. The full InChI is InChI=1S/C10H15N/c1-3-4-9(2)10-5-7-11-8-6-10/h5-9H,3-4H2,1-2H3/t9-/m0/s1.
What are the key properties of 4-[(2S)-pentan-2-yl]pyridine?
4-[(2S)-pentan-2-yl]pyridine has a molecular weight of 149.24 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2S)-pentan-2-yl]pyridine is sourced from PubChem (CID 166675231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).