N,N-dibutyl-1,2,2-triethylpiperidin-3-amine

C19H40N2 — CID 24748233

IUPACN,N-dibutyl-1,2,2-triethylpiperidin-3-amine
SMILESCCCCN(CCCC)C1CCCN(CC)C1(CC)CC
InChIInChI=1S/C19H40N2/c1-6-11-15-20(16-12-7-2)18-14-13-17-21(10-5)19(18,8-3)9-4/h18H,6-17H2,1-5H3
InChIKeySBQNGBOALQQBFL-UHFFFAOYSA-N
MW296.54 g/mol
LogP4.93
Rot. Bonds10

About N,N-dibutyl-1,2,2-triethylpiperidin-3-amine

N,N-dibutyl-1,2,2-triethylpiperidin-3-amine (PubChem CID 24748233) has the molecular formula C19H40N2 and a molecular weight of 296.54 g/mol. Its IUPAC name is N,N-dibutyl-1,2,2-triethylpiperidin-3-amine.

Molecular Properties

Compound NameN,N-dibutyl-1,2,2-triethylpiperidin-3-amine
PubChem CID24748233
Molecular FormulaC19H40N2
Molecular Weight296.54 g/mol
Exact Mass296.32
IUPAC NameN,N-dibutyl-1,2,2-triethylpiperidin-3-amine
SMILESCCCCN(CCCC)C1CCCN(CC)C1(CC)CC
InChIInChI=1S/C19H40N2/c1-6-11-15-20(16-12-7-2)18-14-13-17-21(10-5)19(18,8-3)9-4/h18H,6-17H2,1-5H3
InChIKeySBQNGBOALQQBFL-UHFFFAOYSA-N
XLogP4.93
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.54
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-1,2,2-triethylpiperidin-3-amine?
The IUPAC name of N,N-dibutyl-1,2,2-triethylpiperidin-3-amine (CID 24748233) is N,N-dibutyl-1,2,2-triethylpiperidin-3-amine.
What is the SMILES notation for N,N-dibutyl-1,2,2-triethylpiperidin-3-amine?
The canonical SMILES for N,N-dibutyl-1,2,2-triethylpiperidin-3-amine is CCCCN(CCCC)C1CCCN(CC)C1(CC)CC.
What is the InChIKey of N,N-dibutyl-1,2,2-triethylpiperidin-3-amine?
The InChIKey is SBQNGBOALQQBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2/c1-6-11-15-20(16-12-7-2)18-14-13-17-21(10-5)19(18,8-3)9-4/h18H,6-17H2,1-5H3.
What are the key properties of N,N-dibutyl-1,2,2-triethylpiperidin-3-amine?
N,N-dibutyl-1,2,2-triethylpiperidin-3-amine has a molecular weight of 296.54 g/mol, XLogP of 4.93, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-1,2,2-triethylpiperidin-3-amine is sourced from PubChem (CID 24748233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).