(2S)-4-pyridin-2-ylbutan-2-amine

C9H14N2 — CID 22831528

IUPAC(2S)-4-pyridin-2-ylbutan-2-amine
SMILESC[C@H](N)CCc1ccccn1
InChIInChI=1S/C9H14N2/c1-8(10)5-6-9-4-2-3-7-11-9/h2-4,7-8H,5-6,10H2,1H3/t8-/m0/s1
InChIKeyGWKSNKWKKKLHMV-QMMMGPOBSA-N
MW150.22 g/mol
LogP1.36
Rot. Bonds3

About (2S)-4-pyridin-2-ylbutan-2-amine

(2S)-4-pyridin-2-ylbutan-2-amine (PubChem CID 22831528) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (2S)-4-pyridin-2-ylbutan-2-amine.

Molecular Properties

Compound Name(2S)-4-pyridin-2-ylbutan-2-amine
PubChem CID22831528
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(2S)-4-pyridin-2-ylbutan-2-amine
SMILESC[C@H](N)CCc1ccccn1
InChIInChI=1S/C9H14N2/c1-8(10)5-6-9-4-2-3-7-11-9/h2-4,7-8H,5-6,10H2,1H3/t8-/m0/s1
InChIKeyGWKSNKWKKKLHMV-QMMMGPOBSA-N
XLogP1.36
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
1-ethoxy-4-pyridin-2-ylbutan-2-amine
CID 105165178
1-N-(2-pyridin-2-ylethyl)propane-1,2-diamine
CID 115196859
2-(3-ethyl-4-methylpentyl)pyridine
CID 67454741
2-amino-4-pyridin-2-ylbutanamide
CID 64990711
2-[4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butyl]pyridine
CID 175722818
5-amino-N-(2-pyridin-2-ylethyl)hexanamide
CID 82848295
1-(2-propan-2-ylpyrazol-3-yl)-3-pyridin-2-ylpropan-1-amine
CID 114198061
(2R)-5-pyridin-2-ylpentan-2-ol
CID 149104953
1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine
CID 105121774
1-(2,6-dimethylphenyl)-4-pyridin-2-ylbutan-2-amine
CID 105174650
3-amino-5-pyridin-2-ylpentanamide
CID 154265454

Frequently Asked Questions

What is the IUPAC name of (2S)-4-pyridin-2-ylbutan-2-amine?
The IUPAC name of (2S)-4-pyridin-2-ylbutan-2-amine (CID 22831528) is (2S)-4-pyridin-2-ylbutan-2-amine.
What is the SMILES notation for (2S)-4-pyridin-2-ylbutan-2-amine?
The canonical SMILES for (2S)-4-pyridin-2-ylbutan-2-amine is C[C@H](N)CCc1ccccn1.
What is the InChIKey of (2S)-4-pyridin-2-ylbutan-2-amine?
The InChIKey is GWKSNKWKKKLHMV-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H14N2/c1-8(10)5-6-9-4-2-3-7-11-9/h2-4,7-8H,5-6,10H2,1H3/t8-/m0/s1.
What are the key properties of (2S)-4-pyridin-2-ylbutan-2-amine?
(2S)-4-pyridin-2-ylbutan-2-amine has a molecular weight of 150.22 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-pyridin-2-ylbutan-2-amine is sourced from PubChem (CID 22831528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).