(2S)-2-pyridin-3-ylbutan-2-amine

C9H14N2 — CID 93358668

IUPAC(2S)-2-pyridin-3-ylbutan-2-amine
SMILESCC[C@](C)(N)c1cccnc1
InChIInChI=1S/C9H14N2/c1-3-9(2,10)8-5-4-6-11-7-8/h4-7H,3,10H2,1-2H3/t9-/m0/s1
InChIKeyPZWAFSVCFYGGPR-VIFPVBQESA-N
MW150.22 g/mol
LogP1.67
Rot. Bonds2

About (2S)-2-pyridin-3-ylbutan-2-amine

(2S)-2-pyridin-3-ylbutan-2-amine (PubChem CID 93358668) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (2S)-2-pyridin-3-ylbutan-2-amine.

Molecular Properties

Compound Name(2S)-2-pyridin-3-ylbutan-2-amine
PubChem CID93358668
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(2S)-2-pyridin-3-ylbutan-2-amine
SMILESCC[C@](C)(N)c1cccnc1
InChIInChI=1S/C9H14N2/c1-3-9(2,10)8-5-4-6-11-7-8/h4-7H,3,10H2,1-2H3/t9-/m0/s1
InChIKeyPZWAFSVCFYGGPR-VIFPVBQESA-N
XLogP1.67
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-pyridin-3-yloctan-2-amine
CID 174517914
3-(1-bromo-1-pyridin-3-ylpropyl)pyridine
CID 175286517
(3S)-3-amino-N-methyl-3-pyridin-3-ylbutanamide
CID 89248077
(2S)-2-amino-2-pyridin-3-ylpropanoic acid;hydrochloride
CID 71485674
dichloro(pyridin-3-yl)methanamine
CID 139997720
2-methyl-2-pyridin-3-ylpropane-1,3-diol
CID 130130273
3-(5-methylnonan-5-yl)pyridine
CID 139543665
2,2,4-trimethyl-4-pyridin-3-ylpentan-1-amine
CID 146668087
2-(2-methylbutan-2-ylamino)-2-pyridin-3-ylpropanoic acid
CID 114990173
3-hydroxy-3-methyl-2-phenyl-2-pyridin-3-ylpentanoic acid
CID 68961783
diethyl 2-methyl-2-pyridin-3-ylpropanedioate
CID 57301531
2,4-dimethyl-4-pyridin-3-ylpentan-2-ol
CID 145044151

Frequently Asked Questions

What is the IUPAC name of (2S)-2-pyridin-3-ylbutan-2-amine?
The IUPAC name of (2S)-2-pyridin-3-ylbutan-2-amine (CID 93358668) is (2S)-2-pyridin-3-ylbutan-2-amine.
What is the SMILES notation for (2S)-2-pyridin-3-ylbutan-2-amine?
The canonical SMILES for (2S)-2-pyridin-3-ylbutan-2-amine is CC[C@](C)(N)c1cccnc1.
What is the InChIKey of (2S)-2-pyridin-3-ylbutan-2-amine?
The InChIKey is PZWAFSVCFYGGPR-VIFPVBQESA-N. The full InChI is InChI=1S/C9H14N2/c1-3-9(2,10)8-5-4-6-11-7-8/h4-7H,3,10H2,1-2H3/t9-/m0/s1.
What are the key properties of (2S)-2-pyridin-3-ylbutan-2-amine?
(2S)-2-pyridin-3-ylbutan-2-amine has a molecular weight of 150.22 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-pyridin-3-ylbutan-2-amine is sourced from PubChem (CID 93358668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).