(2R)-1-methoxy-4,4-dimethylpentan-2-amine

C8H19NO — CID 59199805

IUPAC(2R)-1-methoxy-4,4-dimethylpentan-2-amine
SMILESCOC[C@H](N)CC(C)(C)C
InChIInChI=1S/C8H19NO/c1-8(2,3)5-7(9)6-10-4/h7H,5-6,9H2,1-4H3/t7-/m1/s1
InChIKeyPCTDUTZECMEKPK-SSDOTTSWSA-N
MW145.25 g/mol
LogP1.40
Rot. Bonds3

About (2R)-1-methoxy-4,4-dimethylpentan-2-amine

(2R)-1-methoxy-4,4-dimethylpentan-2-amine (PubChem CID 59199805) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is (2R)-1-methoxy-4,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name(2R)-1-methoxy-4,4-dimethylpentan-2-amine
PubChem CID59199805
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name(2R)-1-methoxy-4,4-dimethylpentan-2-amine
SMILESCOC[C@H](N)CC(C)(C)C
InChIInChI=1S/C8H19NO/c1-8(2,3)5-7(9)6-10-4/h7H,5-6,9H2,1-4H3/t7-/m1/s1
InChIKeyPCTDUTZECMEKPK-SSDOTTSWSA-N
XLogP1.40
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-methoxy-4,4-dimethylpentan-2-amine?
The IUPAC name of (2R)-1-methoxy-4,4-dimethylpentan-2-amine (CID 59199805) is (2R)-1-methoxy-4,4-dimethylpentan-2-amine.
What is the SMILES notation for (2R)-1-methoxy-4,4-dimethylpentan-2-amine?
The canonical SMILES for (2R)-1-methoxy-4,4-dimethylpentan-2-amine is COC[C@H](N)CC(C)(C)C.
What is the InChIKey of (2R)-1-methoxy-4,4-dimethylpentan-2-amine?
The InChIKey is PCTDUTZECMEKPK-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H19NO/c1-8(2,3)5-7(9)6-10-4/h7H,5-6,9H2,1-4H3/t7-/m1/s1.
What are the key properties of (2R)-1-methoxy-4,4-dimethylpentan-2-amine?
(2R)-1-methoxy-4,4-dimethylpentan-2-amine has a molecular weight of 145.25 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-methoxy-4,4-dimethylpentan-2-amine is sourced from PubChem (CID 59199805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).