N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine

C10H22N2O — CID 63069693

IUPACN'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine
SMILESCCOC(CN)CCN(C)C1CC1
InChIInChI=1S/C10H22N2O/c1-3-13-10(8-11)6-7-12(2)9-4-5-9/h9-10H,3-8,11H2,1-2H3
InChIKeyGWWRMUIZDABALD-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.83
Rot. Bonds7

About N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine

N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine (PubChem CID 63069693) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine
PubChem CID63069693
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine
SMILESCCOC(CN)CCN(C)C1CC1
InChIInChI=1S/C10H22N2O/c1-3-13-10(8-11)6-7-12(2)9-4-5-9/h9-10H,3-8,11H2,1-2H3
InChIKeyGWWRMUIZDABALD-UHFFFAOYSA-N
XLogP0.83
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclopropyl-2-ethoxy-N'-methylpropane-1,3-diamine
CID 63070989
(2R)-2-ethoxy-N',N'-dimethylbutane-1,4-diamine
CID 95006031
2-[(4-amino-3-ethoxybutyl)-cyclohexylamino]ethanol
CID 63070100
2-ethoxy-N'-methyl-N'-(4-methylpentan-2-yl)butane-1,4-diamine
CID 63070283
2-ethoxy-N'-methyl-N'-(4-methylphenyl)butane-1,4-diamine
CID 63071036
2-ethoxy-N'-(4-ethylphenyl)-N'-methylbutane-1,4-diamine
CID 63070653
2-ethoxy-4-(oxetan-3-yloxy)butan-1-amine
CID 102605740
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
1-cyclopropyl-2-[4-(dimethylamino)-2-ethoxybutyl]-1-methylguanidine;hydroiodide
CID 110031536
2-ethoxy-N'-methyl-N'-[(1-methylpyrrolidin-3-yl)methyl]propane-1,3-diamine
CID 63276105

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine?
The IUPAC name of N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine (CID 63069693) is N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine.
What is the SMILES notation for N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine?
The canonical SMILES for N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine is CCOC(CN)CCN(C)C1CC1.
What is the InChIKey of N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine?
The InChIKey is GWWRMUIZDABALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-3-13-10(8-11)6-7-12(2)9-4-5-9/h9-10H,3-8,11H2,1-2H3.
What are the key properties of N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine?
N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine has a molecular weight of 186.30 g/mol, XLogP of 0.83, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-2-ethoxy-N'-methylbutane-1,4-diamine is sourced from PubChem (CID 63069693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).