(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine

C9H21NO — CID 163903931

IUPAC(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine
SMILESCOC[C@H](C)[C@@H](C)CN(C)C
InChIInChI=1S/C9H21NO/c1-8(6-10(3)4)9(2)7-11-5/h8-9H,6-7H2,1-5H3/t8-,9-/m0/s1
InChIKeyQMGIEAQLWKZGGL-IUCAKERBSA-N
MW159.27 g/mol
LogP1.47
Rot. Bonds5

About (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine

(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine (PubChem CID 163903931) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine.

Molecular Properties

Compound Name(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine
PubChem CID163903931
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine
SMILESCOC[C@H](C)[C@@H](C)CN(C)C
InChIInChI=1S/C9H21NO/c1-8(6-10(3)4)9(2)7-11-5/h8-9H,6-7H2,1-5H3/t8-,9-/m0/s1
InChIKeyQMGIEAQLWKZGGL-IUCAKERBSA-N
XLogP1.47
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxy-N,N,2,3-tetramethylpentan-1-amine
CID 144662876
ethane;5-methoxy-N,N,2,3-tetramethylpentan-1-amine
CID 144662875
(2R)-N,N,2,3-tetramethylpentan-1-amine
CID 130182039
1,4-dimethoxy-2-(methoxymethyl)-3-methylbutane
CID 59866935
(3S)-3-iodo-1-methoxy-2-methylbutane
CID 88880583
(2R)-4-methoxy-3-methylbutan-2-amine
CID 134348590
5-[3-amino-5-(dimethylamino)-4-methylpentoxy]-1-N,1-N,2-trimethylpentane-1,3-diamine
CID 88716268
4-methoxy-2-N,3-dimethyl-2-N-(3-methylbutyl)butane-1,2-diamine
CID 116501663
4-methoxy-2,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 81015723
1-(3-methoxy-2-methylpropyl)-1-methylhydrazine
CID 126997518
N'-(2-chloro-3-methoxypropyl)-N,N,N'-trimethylethane-1,2-diamine
CID 63387619
(3E)-3-(fluoromethylidene)-2-(methoxymethyl)-N,N-dimethylpentan-1-amine
CID 177009601

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine?
The IUPAC name of (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine (CID 163903931) is (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine.
What is the SMILES notation for (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine?
The canonical SMILES for (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine is COC[C@H](C)[C@@H](C)CN(C)C.
What is the InChIKey of (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine?
The InChIKey is QMGIEAQLWKZGGL-IUCAKERBSA-N. The full InChI is InChI=1S/C9H21NO/c1-8(6-10(3)4)9(2)7-11-5/h8-9H,6-7H2,1-5H3/t8-,9-/m0/s1.
What are the key properties of (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine?
(2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine has a molecular weight of 159.27 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-4-methoxy-N,N,2,3-tetramethylbutan-1-amine is sourced from PubChem (CID 163903931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).