(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine

C8H20N2O — CID 95006031

IUPAC(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine
SMILESCCO[C@@H](CN)CCN(C)C
InChIInChI=1S/C8H20N2O/c1-4-11-8(7-9)5-6-10(2)3/h8H,4-7,9H2,1-3H3/t8-/m1/s1
InChIKeyUDYGMTDODPECSM-MRVPVSSYSA-N
MW160.26 g/mol
LogP0.30
Rot. Bonds6

About (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine

(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine (PubChem CID 95006031) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine.

Molecular Properties

Compound Name(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine
PubChem CID95006031
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC Name(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine
SMILESCCO[C@@H](CN)CCN(C)C
InChIInChI=1S/C8H20N2O/c1-4-11-8(7-9)5-6-10(2)3/h8H,4-7,9H2,1-3H3/t8-/m1/s1
InChIKeyUDYGMTDODPECSM-MRVPVSSYSA-N
XLogP0.30
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine
CID 63069693
2-ethoxy-N'-methyl-N'-(4-methylpentan-2-yl)butane-1,4-diamine
CID 63070283
2-methoxy-N',N'-dimethylbutane-1,4-diamine
CID 83826305
2-[(4-amino-3-ethoxybutyl)-methylamino]acetamide
CID 63070450
N'-[3-(diethylamino)propyl]-2-ethoxy-N'-ethylbutane-1,4-diamine
CID 102991675
2-ethoxy-N'-methyl-N'-(4-methylphenyl)butane-1,4-diamine
CID 63071036
1-[(4-amino-3-ethoxybutyl)-methylamino]-3-methoxypropan-2-ol
CID 63070098
2-ethoxy-N'-(4-ethylphenyl)-N'-methylbutane-1,4-diamine
CID 63070653
N'-butan-2-yl-N'-butyl-2-ethoxybutane-1,4-diamine
CID 63070467
2-ethoxy-N'-ethyl-N'-(2,2,2-trifluoroethyl)butane-1,4-diamine
CID 63069720
2-ethoxy-N'-ethyl-N'-methylpropane-1,3-diamine
CID 63070797
2-[4-(dimethylamino)-2-ethoxybutyl]-1,1,3,3-tetramethylguanidine
CID 111975347

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine?
The IUPAC name of (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine (CID 95006031) is (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine.
What is the SMILES notation for (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine?
The canonical SMILES for (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine is CCO[C@@H](CN)CCN(C)C.
What is the InChIKey of (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine?
The InChIKey is UDYGMTDODPECSM-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H20N2O/c1-4-11-8(7-9)5-6-10(2)3/h8H,4-7,9H2,1-3H3/t8-/m1/s1.
What are the key properties of (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine?
(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine has a molecular weight of 160.26 g/mol, XLogP of 0.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine is sourced from PubChem (CID 95006031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).