N,N-diethylethanamine;N,N-dipropylpropan-1-amine

C15H36N2 — CID 22257187

IUPACN,N-diethylethanamine;N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCC.CCN(CC)CC
InChIInChI=1S/C9H21N.C6H15N/c1-4-7-10(8-5-2)9-6-3;1-4-7(5-2)6-3/h4-9H2,1-3H3;4-6H2,1-3H3
InChIKeyITOXMFKNJNRZDT-UHFFFAOYSA-N
MW244.47 g/mol
LogP3.87
Rot. Bonds9

About N,N-diethylethanamine;N,N-dipropylpropan-1-amine

N,N-diethylethanamine;N,N-dipropylpropan-1-amine (PubChem CID 22257187) has the molecular formula C15H36N2 and a molecular weight of 244.47 g/mol. Its IUPAC name is N,N-diethylethanamine;N,N-dipropylpropan-1-amine.

Molecular Properties

Compound NameN,N-diethylethanamine;N,N-dipropylpropan-1-amine
PubChem CID22257187
Molecular FormulaC15H36N2
Molecular Weight244.47 g/mol
Exact Mass244.29
IUPAC NameN,N-diethylethanamine;N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCC.CCN(CC)CC
InChIInChI=1S/C9H21N.C6H15N/c1-4-7-10(8-5-2)9-6-3;1-4-7(5-2)6-3/h4-9H2,1-3H3;4-6H2,1-3H3
InChIKeyITOXMFKNJNRZDT-UHFFFAOYSA-N
XLogP3.87
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.47
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813
N,N-diethylpropan-1-amine;methane
CID 144711865
N,N-dipropylpropan-1-amine;pentahydrochloride
CID 172789957
Tripropylamineborane
CID 21315686
N,N-dipropylpropan-1-amine;propane
CID 174574210
sodium;N,N-dipropylpropan-1-amine;chloride
CID 175189857
ethane;N-ethyl-N-propylpropan-1-amine;hexane
CID 167521099
N,N-diethylpropan-1-amine;2-methylpropane
CID 143334042
N,N-diethylethanamine;ethane
CID 22114990
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dibromide
CID 173220545
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dichloride
CID 173220390
N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine
CID 160933502

Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;N,N-dipropylpropan-1-amine?
The IUPAC name of N,N-diethylethanamine;N,N-dipropylpropan-1-amine (CID 22257187) is N,N-diethylethanamine;N,N-dipropylpropan-1-amine.
What is the SMILES notation for N,N-diethylethanamine;N,N-dipropylpropan-1-amine?
The canonical SMILES for N,N-diethylethanamine;N,N-dipropylpropan-1-amine is CCCN(CCC)CCC.CCN(CC)CC.
What is the InChIKey of N,N-diethylethanamine;N,N-dipropylpropan-1-amine?
The InChIKey is ITOXMFKNJNRZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N.C6H15N/c1-4-7-10(8-5-2)9-6-3;1-4-7(5-2)6-3/h4-9H2,1-3H3;4-6H2,1-3H3.
What are the key properties of N,N-diethylethanamine;N,N-dipropylpropan-1-amine?
N,N-diethylethanamine;N,N-dipropylpropan-1-amine has a molecular weight of 244.47 g/mol, XLogP of 3.87, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;N,N-dipropylpropan-1-amine is sourced from PubChem (CID 22257187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).