(2R)-N-methylbutan-2-amine

C5H13N — CID 18596121

IUPAC(2R)-N-methylbutan-2-amine
SMILESCC[C@@H](C)NC
InChIInChI=1S/C5H13N/c1-4-5(2)6-3/h5-6H,4H2,1-3H3/t5-/m1/s1
InChIKeyPYFSCIWXNSXGNS-RXMQYKEDSA-N
MW87.17 g/mol
LogP1.00
Rot. Bonds2

About (2R)-N-methylbutan-2-amine

(2R)-N-methylbutan-2-amine (PubChem CID 18596121) has the molecular formula C5H13N and a molecular weight of 87.17 g/mol. Its IUPAC name is (2R)-N-methylbutan-2-amine.

Molecular Properties

Compound Name(2R)-N-methylbutan-2-amine
PubChem CID18596121
Molecular FormulaC5H13N
Molecular Weight87.17 g/mol
Exact Mass87.10
IUPAC Name(2R)-N-methylbutan-2-amine
SMILESCC[C@@H](C)NC
InChIInChI=1S/C5H13N/c1-4-5(2)6-3/h5-6H,4H2,1-3H3/t5-/m1/s1
InChIKeyPYFSCIWXNSXGNS-RXMQYKEDSA-N
XLogP1.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.17
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-methylbutan-2-amine?
The IUPAC name of (2R)-N-methylbutan-2-amine (CID 18596121) is (2R)-N-methylbutan-2-amine.
What is the SMILES notation for (2R)-N-methylbutan-2-amine?
The canonical SMILES for (2R)-N-methylbutan-2-amine is CC[C@@H](C)NC.
What is the InChIKey of (2R)-N-methylbutan-2-amine?
The InChIKey is PYFSCIWXNSXGNS-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H13N/c1-4-5(2)6-3/h5-6H,4H2,1-3H3/t5-/m1/s1.
What are the key properties of (2R)-N-methylbutan-2-amine?
(2R)-N-methylbutan-2-amine has a molecular weight of 87.17 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methylbutan-2-amine is sourced from PubChem (CID 18596121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).