N,N-diethylpropan-1-amine;2-methylpropane

C11H27N — CID 143334042

IUPACN,N-diethylpropan-1-amine;2-methylpropane
SMILESCC(C)C.CCCN(CC)CC
InChIInChI=1S/C7H17N.C4H10/c1-4-7-8(5-2)6-3;1-4(2)3/h4-7H2,1-3H3;4H,1-3H3
InChIKeyDJUWHMARUSNUCS-UHFFFAOYSA-N
MW173.34 g/mol
LogP3.40
Rot. Bonds4

About N,N-diethylpropan-1-amine;2-methylpropane

N,N-diethylpropan-1-amine;2-methylpropane (PubChem CID 143334042) has the molecular formula C11H27N and a molecular weight of 173.34 g/mol. Its IUPAC name is N,N-diethylpropan-1-amine;2-methylpropane.

Molecular Properties

Compound NameN,N-diethylpropan-1-amine;2-methylpropane
PubChem CID143334042
Molecular FormulaC11H27N
Molecular Weight173.34 g/mol
Exact Mass173.21
IUPAC NameN,N-diethylpropan-1-amine;2-methylpropane
SMILESCC(C)C.CCCN(CC)CC
InChIInChI=1S/C7H17N.C4H10/c1-4-7-8(5-2)6-3;1-4(2)3/h4-7H2,1-3H3;4H,1-3H3
InChIKeyDJUWHMARUSNUCS-UHFFFAOYSA-N
XLogP3.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.34
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-diethylpropan-1-amine;methane
CID 144711865
N,N-diethylethanamine;N,N-dipropylpropan-1-amine
CID 22257187
N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine
CID 160933502
N-ethyl-3-methyl-N-propylbutan-1-amine
CID 89085287
N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813
N-ethyl-N'-(2-methylpropyl)-N,N'-dipropylethane-1,2-diamine
CID 123205995
ethane;N-ethyl-N-propylpropan-1-amine;hexane
CID 167521099
N-ethyl-3-methyl-N-propylpentan-1-amine
CID 126690332
1-N-ethyl-1-N-propylbutane-1,3-diamine
CID 43268683
N,N-dipropylpropan-1-amine;pentahydrochloride
CID 172789957
Tripropylamineborane
CID 21315686
N,N-dipropylpropan-1-amine;propane
CID 174574210

Frequently Asked Questions

What is the IUPAC name of N,N-diethylpropan-1-amine;2-methylpropane?
The IUPAC name of N,N-diethylpropan-1-amine;2-methylpropane (CID 143334042) is N,N-diethylpropan-1-amine;2-methylpropane.
What is the SMILES notation for N,N-diethylpropan-1-amine;2-methylpropane?
The canonical SMILES for N,N-diethylpropan-1-amine;2-methylpropane is CC(C)C.CCCN(CC)CC.
What is the InChIKey of N,N-diethylpropan-1-amine;2-methylpropane?
The InChIKey is DJUWHMARUSNUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N.C4H10/c1-4-7-8(5-2)6-3;1-4(2)3/h4-7H2,1-3H3;4H,1-3H3.
What are the key properties of N,N-diethylpropan-1-amine;2-methylpropane?
N,N-diethylpropan-1-amine;2-methylpropane has a molecular weight of 173.34 g/mol, XLogP of 3.40, 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;2-methylpropane is sourced from PubChem (CID 143334042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).