N,N-diethylpropan-1-amine;methane

C8H21N — CID 144711865

IUPACN,N-diethylpropan-1-amine;methane
SMILESC.CCCN(CC)CC
InChIInChI=1S/C7H17N.CH4/c1-4-7-8(5-2)6-3;/h4-7H2,1-3H3;1H4
InChIKeyXXYIUFXPQCKKCC-UHFFFAOYSA-N
MW131.26 g/mol
LogP2.37
Rot. Bonds4

About N,N-diethylpropan-1-amine;methane

N,N-diethylpropan-1-amine;methane (PubChem CID 144711865) has the molecular formula C8H21N and a molecular weight of 131.26 g/mol. Its IUPAC name is N,N-diethylpropan-1-amine;methane.

Molecular Properties

Compound NameN,N-diethylpropan-1-amine;methane
PubChem CID144711865
Molecular FormulaC8H21N
Molecular Weight131.26 g/mol
Exact Mass131.17
IUPAC NameN,N-diethylpropan-1-amine;methane
SMILESC.CCCN(CC)CC
InChIInChI=1S/C7H17N.CH4/c1-4-7-8(5-2)6-3;/h4-7H2,1-3H3;1H4
InChIKeyXXYIUFXPQCKKCC-UHFFFAOYSA-N
XLogP2.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.26
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-diethylpropan-1-amine;2-methylpropane
CID 143334042
N,N-diethylethanamine;N,N-dipropylpropan-1-amine
CID 22257187
N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine
CID 160933502
N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813
ethane;N-ethyl-N-propylpropan-1-amine;hexane
CID 167521099
tetrakis(N,N-diethylbutan-1-amine);ethane;methane
CID 157434901
Tripropylamineborane
CID 21315686
N,N-dipropylpropan-1-amine;pentahydrochloride
CID 172789957
N,N-dipropylpropan-1-amine;propane
CID 174574210
N-ethyl-N-propylbutan-1-amine;pentane
CID 143329949
2-[ethyl(2-hydroxyethyl)amino]ethanol;2-[ethyl(propyl)amino]ethanol
CID 161297591
sodium;N,N-dipropylpropan-1-amine;chloride
CID 175189857

Frequently Asked Questions

What is the IUPAC name of N,N-diethylpropan-1-amine;methane?
The IUPAC name of N,N-diethylpropan-1-amine;methane (CID 144711865) is N,N-diethylpropan-1-amine;methane.
What is the SMILES notation for N,N-diethylpropan-1-amine;methane?
The canonical SMILES for N,N-diethylpropan-1-amine;methane is C.CCCN(CC)CC.
What is the InChIKey of N,N-diethylpropan-1-amine;methane?
The InChIKey is XXYIUFXPQCKKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N.CH4/c1-4-7-8(5-2)6-3;/h4-7H2,1-3H3;1H4.
What are the key properties of N,N-diethylpropan-1-amine;methane?
N,N-diethylpropan-1-amine;methane has a molecular weight of 131.26 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylpropan-1-amine;methane is sourced from PubChem (CID 144711865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).