[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium

C6H15N2O+ — CID 7271814

IUPAC[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium
SMILESCC(C)C[C@@H]([NH3+])C(N)=O
InChIInChI=1S/C6H14N2O/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H2,8,9)/p+1/t5-/m1/s1
InChIKeyFORGMRSGVSYZQR-RXMQYKEDSA-O
MW131.20 g/mol
LogP-0.87
Rot. Bonds3

About [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium

[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium (PubChem CID 7271814) has the molecular formula C6H15N2O+ and a molecular weight of 131.20 g/mol. Its IUPAC name is [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium.

Molecular Properties

Compound Name[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium
PubChem CID7271814
Molecular FormulaC6H15N2O+
Molecular Weight131.20 g/mol
Exact Mass131.12
IUPAC Name[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium
SMILESCC(C)C[C@@H]([NH3+])C(N)=O
InChIInChI=1S/C6H14N2O/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H2,8,9)/p+1/t5-/m1/s1
InChIKeyFORGMRSGVSYZQR-RXMQYKEDSA-O
XLogP-0.87
TPSA70.73 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.20
LogP ≤ 5-0.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

[(2S)-1-ethoxy-4-methyl-1-oxopentan-2-yl]azanium
CID 6994014
[(3R)-1-hydroxy-5-methyl-2-oxohexan-3-yl]azanium chloride
CID 11446703
(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium
CID 25201551
2-chloro-4-methylpentanamide
CID 62224745
[(1S)-1-carboxy-3-methylbutyl]azanium nitrate
CID 139067720
ethane;4-methyl-2-sulfanylpentanamide
CID 143641948
(2S)-2-amino-4-methylpentanamide;ethane;molecular hydrogen
CID 145052897
2-(hydroxyamino)-4-methylpentanamide
CID 14584858
(2R)-4-methyl-2-(methylamino)pentanamide
CID 89050865
(2R)-2-(2-methylpropyl)butanediamide
CID 22942178
2-methoxy-4-methylpentanamide
CID 130746931
2-methylpropanamide;bis(propan-2-one)
CID 174404145

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium?
The IUPAC name of [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium (CID 7271814) is [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium.
What is the SMILES notation for [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium?
The canonical SMILES for [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium is CC(C)C[C@@H]([NH3+])C(N)=O.
What is the InChIKey of [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium?
The InChIKey is FORGMRSGVSYZQR-RXMQYKEDSA-O. The full InChI is InChI=1S/C6H14N2O/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H2,8,9)/p+1/t5-/m1/s1.
What are the key properties of [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium?
[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium has a molecular weight of 131.20 g/mol, XLogP of -0.87, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium is sourced from PubChem (CID 7271814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).