N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine

C16H35N3 — CID 24748231

IUPACN,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine
SMILESCCN1CCCC(N(C)CCN(C)C)C1(CC)CC
InChIInChI=1S/C16H35N3/c1-7-16(8-2)15(11-10-12-19(16)9-3)18(6)14-13-17(4)5/h15H,7-14H2,1-6H3
InChIKeyFTIZOBVJPDDHKA-UHFFFAOYSA-N
MW269.48 g/mol
LogP2.52
Rot. Bonds7

About N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine

N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine (PubChem CID 24748231) has the molecular formula C16H35N3 and a molecular weight of 269.48 g/mol. Its IUPAC name is N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine
PubChem CID24748231
Molecular FormulaC16H35N3
Molecular Weight269.48 g/mol
Exact Mass269.28
IUPAC NameN,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine
SMILESCCN1CCCC(N(C)CCN(C)C)C1(CC)CC
InChIInChI=1S/C16H35N3/c1-7-16(8-2)15(11-10-12-19(16)9-3)18(6)14-13-17(4)5/h15H,7-14H2,1-6H3
InChIKeyFTIZOBVJPDDHKA-UHFFFAOYSA-N
XLogP2.52
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.48
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine?
The IUPAC name of N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine (CID 24748231) is N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine?
The canonical SMILES for N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine is CCN1CCCC(N(C)CCN(C)C)C1(CC)CC.
What is the InChIKey of N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine?
The InChIKey is FTIZOBVJPDDHKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3/c1-7-16(8-2)15(11-10-12-19(16)9-3)18(6)14-13-17(4)5/h15H,7-14H2,1-6H3.
What are the key properties of N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine?
N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine has a molecular weight of 269.48 g/mol, XLogP of 2.52, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N'-trimethyl-N'-(1,2,2-triethylpiperidin-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 24748231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).