(2S)-hexan-2-amine

C6H15N — CID 6999846

IUPAC(2S)-hexan-2-amine
SMILESCCCC[C@H](C)N
InChIInChI=1S/C6H15N/c1-3-4-5-6(2)7/h6H,3-5,7H2,1-2H3/t6-/m0/s1
InChIKeyWGBBUURBHXLGFM-LURJTMIESA-N
MW101.19 g/mol
LogP1.52
Rot. Bonds3

About (2S)-hexan-2-amine

(2S)-hexan-2-amine (PubChem CID 6999846) has the molecular formula C6H15N and a molecular weight of 101.19 g/mol. Its IUPAC name is (2S)-hexan-2-amine.

Molecular Properties

Compound Name(2S)-hexan-2-amine
PubChem CID6999846
Molecular FormulaC6H15N
Molecular Weight101.19 g/mol
Exact Mass101.12
IUPAC Name(2S)-hexan-2-amine
SMILESCCCC[C@H](C)N
InChIInChI=1S/C6H15N/c1-3-4-5-6(2)7/h6H,3-5,7H2,1-2H3/t6-/m0/s1
InChIKeyWGBBUURBHXLGFM-LURJTMIESA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.19
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-hexan-2-amine?
The IUPAC name of (2S)-hexan-2-amine (CID 6999846) is (2S)-hexan-2-amine.
What is the SMILES notation for (2S)-hexan-2-amine?
The canonical SMILES for (2S)-hexan-2-amine is CCCC[C@H](C)N.
What is the InChIKey of (2S)-hexan-2-amine?
The InChIKey is WGBBUURBHXLGFM-LURJTMIESA-N. The full InChI is InChI=1S/C6H15N/c1-3-4-5-6(2)7/h6H,3-5,7H2,1-2H3/t6-/m0/s1.
What are the key properties of (2S)-hexan-2-amine?
(2S)-hexan-2-amine has a molecular weight of 101.19 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-hexan-2-amine is sourced from PubChem (CID 6999846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).