N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine

C15H36N2 — CID 160933502

IUPACN,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine
SMILESCCCCN(CC)CC.CCCN(CC)CC
InChIInChI=1S/C8H19N.C7H17N/c1-4-7-8-9(5-2)6-3;1-4-7-8(5-2)6-3/h4-8H2,1-3H3;4-7H2,1-3H3
InChIKeySTONIWCECZLFSN-UHFFFAOYSA-N
MW244.47 g/mol
LogP3.87
Rot. Bonds9

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

N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine (PubChem CID 160933502) has the molecular formula C15H36N2 and a molecular weight of 244.47 g/mol. Its IUPAC name is N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine.

Molecular Properties

Compound NameN,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine
PubChem CID160933502
Molecular FormulaC15H36N2
Molecular Weight244.47 g/mol
Exact Mass244.29
IUPAC NameN,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine
SMILESCCCCN(CC)CC.CCCN(CC)CC
InChIInChI=1S/C8H19N.C7H17N/c1-4-7-8-9(5-2)6-3;1-4-7-8(5-2)6-3/h4-8H2,1-3H3;4-7H2,1-3H3
InChIKeySTONIWCECZLFSN-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-propylbutan-1-amine;pentane
CID 143329949
tetrakis(N,N-diethylbutan-1-amine);ethane;methane
CID 157434901
N',N'-dibutyl-N,N-diethylethane-1,2-diamine
CID 91548124
N,N-dipropylbutan-1-amine;hydrofluoride
CID 19783533
ethane;N-ethyl-N-propylpropan-1-amine;hexane
CID 167521099
N,N-diethylpropan-1-amine;methane
CID 144711865
N-ethyl-N-propyldecan-1-amine
CID 56933807
N-butyl-N-ethylbutan-1-amine;N-ethyl-N-pentylpentan-1-amine
CID 160957267
N-ethyl-N-propylbutan-1-amine;methane;prop-1-ene
CID 178172448
N-ethyl-N,N'-di(nonyl)-N'-propylpropane-1,3-diamine
CID 171750142
N,N-diethylpropan-1-amine;2-methylpropane
CID 143334042
N,N,N'-triethyl-N'-tetradecylpropane-1,3-diamine
CID 19837420

Frequently Asked Questions

What is the IUPAC name of N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine?
The IUPAC name of N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine (CID 160933502) is N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine.
What is the SMILES notation for N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine?
The canonical SMILES for N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine is CCCCN(CC)CC.CCCN(CC)CC.
What is the InChIKey of N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine?
The InChIKey is STONIWCECZLFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C7H17N/c1-4-7-8-9(5-2)6-3;1-4-7-8(5-2)6-3/h4-8H2,1-3H3;4-7H2,1-3H3.
What are the key properties of N,N-diethylbutan-1-amine;N,N-diethylpropan-1-amine?
N,N-diethylbutan-1-amine;N,N-diethylpropan-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-diethylbutan-1-amine;N,N-diethylpropan-1-amine is sourced from PubChem (CID 160933502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).