N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine

C10H24N2O — CID 65176413

IUPACN'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine
SMILESCCCN(CCN)CCCOCC
InChIInChI=1S/C10H24N2O/c1-3-7-12(9-6-11)8-5-10-13-4-2/h3-11H2,1-2H3
InChIKeyKZNODOKUSBFRHZ-UHFFFAOYSA-N
MW188.31 g/mol
LogP1.08
Rot. Bonds9

About N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine

N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine (PubChem CID 65176413) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine
PubChem CID65176413
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC NameN'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine
SMILESCCCN(CCN)CCCOCC
InChIInChI=1S/C10H24N2O/c1-3-7-12(9-6-11)8-5-10-13-4-2/h3-11H2,1-2H3
InChIKeyKZNODOKUSBFRHZ-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-[3-(2-methoxyethoxy)propyl]-N'-propylethane-1,2-diamine
CID 103409202
2-[3-ethoxypropyl(propyl)amino]acetic acid
CID 65180824
N,N-bis(2-ethoxyethyl)butan-1-amine
CID 91213413
N'-(2-ethoxyethyl)-N'-(2-methoxyethyl)propane-1,3-diamine
CID 55220253
N'-(2-aminoethyl)-N'-hexylethane-1,2-diamine
CID 62923108
N-(3-butoxypropyl)-N-butylbutan-1-amine
CID 152720768
N'-(2-butoxyethyl)-N'-ethylethane-1,2-diamine
CID 61483279
3-[3-ethoxypropyl(propyl)amino]-2-methylpropanoic acid
CID 82328136
ethane;1-ethoxybutane
CID 143206406
4-ethoxybutan-1-amine;hydrochloride
CID 87771260
3-(4-ethoxybutoxy)propan-1-amine
CID 87914179
N-(3-methoxypropyl)-N-propylbutan-1-amine
CID 148527090

Frequently Asked Questions

What is the IUPAC name of N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine?
The IUPAC name of N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine (CID 65176413) is N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine.
What is the SMILES notation for N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine?
The canonical SMILES for N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine is CCCN(CCN)CCCOCC.
What is the InChIKey of N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine?
The InChIKey is KZNODOKUSBFRHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-3-7-12(9-6-11)8-5-10-13-4-2/h3-11H2,1-2H3.
What are the key properties of N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine?
N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine has a molecular weight of 188.31 g/mol, XLogP of 1.08, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-ethoxypropyl)-N'-propylethane-1,2-diamine is sourced from PubChem (CID 65176413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).