(2R)-2-deuterio-3-methylbutan-2-amine

C5H13N — CID 122205559

IUPAC(2R)-2-deuterio-3-methylbutan-2-amine
SMILES[2H][C@](C)(N)C(C)C
InChIInChI=1S/C5H13N/c1-4(2)5(3)6/h4-5H,6H2,1-3H3/t5-/m1/s1/i5D
InChIKeyJOZZAIIGWFLONA-VORAJLQXSA-N
MW88.17 g/mol
LogP0.99
Rot. Bonds1

About (2R)-2-deuterio-3-methylbutan-2-amine

(2R)-2-deuterio-3-methylbutan-2-amine (PubChem CID 122205559) has the molecular formula C5H13N and a molecular weight of 88.17 g/mol. Its IUPAC name is (2R)-2-deuterio-3-methylbutan-2-amine.

Molecular Properties

Compound Name(2R)-2-deuterio-3-methylbutan-2-amine
PubChem CID122205559
Molecular FormulaC5H13N
Molecular Weight88.17 g/mol
Exact Mass88.11
IUPAC Name(2R)-2-deuterio-3-methylbutan-2-amine
SMILES[2H][C@](C)(N)C(C)C
InChIInChI=1S/C5H13N/c1-4(2)5(3)6/h4-5H,6H2,1-3H3/t5-/m1/s1/i5D
InChIKeyJOZZAIIGWFLONA-VORAJLQXSA-N
XLogP0.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.17
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-deuterio-2,3-dimethylbutane
CID 154589489
(2R)-3-methylbutan-2-amine
CID 6999786
(2S)-3-methylbutan-2-amine;2-methylpropane
CID 161042679
hydron;propan-2-amine
CID 174699722
ethane-1,1-diamine;tetrahydrochloride
CID 142050640
(3R)-butane-2,3-diamine
CID 172719520
copper;bis(ethane-1,1-diamine)
CID 118678530
alumane;ethane-1,1-diamine
CID 174593574
(2R,3R)-butane-2,3-diamine;dihydrochloride
CID 90474575
propan-2-amine;hydrate;hydrochloride
CID 162153809
(2R)-propane-1,1,2-triamine
CID 164890165
beryllium;hydride;propan-2-amine
CID 174791883

Frequently Asked Questions

What is the IUPAC name of (2R)-2-deuterio-3-methylbutan-2-amine?
The IUPAC name of (2R)-2-deuterio-3-methylbutan-2-amine (CID 122205559) is (2R)-2-deuterio-3-methylbutan-2-amine.
What is the SMILES notation for (2R)-2-deuterio-3-methylbutan-2-amine?
The canonical SMILES for (2R)-2-deuterio-3-methylbutan-2-amine is [2H][C@](C)(N)C(C)C.
What is the InChIKey of (2R)-2-deuterio-3-methylbutan-2-amine?
The InChIKey is JOZZAIIGWFLONA-VORAJLQXSA-N. The full InChI is InChI=1S/C5H13N/c1-4(2)5(3)6/h4-5H,6H2,1-3H3/t5-/m1/s1/i5D.
What are the key properties of (2R)-2-deuterio-3-methylbutan-2-amine?
(2R)-2-deuterio-3-methylbutan-2-amine has a molecular weight of 88.17 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-deuterio-3-methylbutan-2-amine is sourced from PubChem (CID 122205559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).