N,N-dibutylbutan-1-amine;N-ethylethanamine

C16H38N2 — CID 19827528

IUPACN,N-dibutylbutan-1-amine;N-ethylethanamine
SMILESCCCCN(CCCC)CCCC.CCNCC
InChIInChI=1S/C12H27N.C4H11N/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3-5-4-2/h4-12H2,1-3H3;5H,3-4H2,1-2H3
InChIKeyLONHRYRKKYEUNW-UHFFFAOYSA-N
MW258.49 g/mol
LogP4.30
Rot. Bonds11

About N,N-dibutylbutan-1-amine;N-ethylethanamine

N,N-dibutylbutan-1-amine;N-ethylethanamine (PubChem CID 19827528) has the molecular formula C16H38N2 and a molecular weight of 258.49 g/mol. Its IUPAC name is N,N-dibutylbutan-1-amine;N-ethylethanamine.

Molecular Properties

Compound NameN,N-dibutylbutan-1-amine;N-ethylethanamine
PubChem CID19827528
Molecular FormulaC16H38N2
Molecular Weight258.49 g/mol
Exact Mass258.30
IUPAC NameN,N-dibutylbutan-1-amine;N-ethylethanamine
SMILESCCCCN(CCCC)CCCC.CCNCC
InChIInChI=1S/C12H27N.C4H11N/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3-5-4-2/h4-12H2,1-3H3;5H,3-4H2,1-2H3
InChIKeyLONHRYRKKYEUNW-UHFFFAOYSA-N
XLogP4.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.49
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutylbutan-1-amine;N-ethylethanamine?
The IUPAC name of N,N-dibutylbutan-1-amine;N-ethylethanamine (CID 19827528) is N,N-dibutylbutan-1-amine;N-ethylethanamine.
What is the SMILES notation for N,N-dibutylbutan-1-amine;N-ethylethanamine?
The canonical SMILES for N,N-dibutylbutan-1-amine;N-ethylethanamine is CCCCN(CCCC)CCCC.CCNCC.
What is the InChIKey of N,N-dibutylbutan-1-amine;N-ethylethanamine?
The InChIKey is LONHRYRKKYEUNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N.C4H11N/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3-5-4-2/h4-12H2,1-3H3;5H,3-4H2,1-2H3.
What are the key properties of N,N-dibutylbutan-1-amine;N-ethylethanamine?
N,N-dibutylbutan-1-amine;N-ethylethanamine has a molecular weight of 258.49 g/mol, XLogP of 4.30, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutylbutan-1-amine;N-ethylethanamine is sourced from PubChem (CID 19827528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).