1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine

C16H33N3 — CID 114430948

IUPAC1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine
SMILESCCC1CCNC(CN(C)C2CCN(CC)CC2)C1
InChIInChI=1S/C16H33N3/c1-4-14-6-9-17-15(12-14)13-18(3)16-7-10-19(5-2)11-8-16/h14-17H,4-13H2,1-3H3
InChIKeyDZSLZZIYELENFN-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.18
Rot. Bonds5

About 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine

1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine (PubChem CID 114430948) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine
PubChem CID114430948
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine
SMILESCCC1CCNC(CN(C)C2CCN(CC)CC2)C1
InChIInChI=1S/C16H33N3/c1-4-14-6-9-17-15(12-14)13-18(3)16-7-10-19(5-2)11-8-16/h14-17H,4-13H2,1-3H3
InChIKeyDZSLZZIYELENFN-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine?
The IUPAC name of 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine (CID 114430948) is 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine is CCC1CCNC(CN(C)C2CCN(CC)CC2)C1.
What is the InChIKey of 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine?
The InChIKey is DZSLZZIYELENFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-4-14-6-9-17-15(12-14)13-18(3)16-7-10-19(5-2)11-8-16/h14-17H,4-13H2,1-3H3.
What are the key properties of 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine?
1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine has a molecular weight of 267.46 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(4-ethylpiperidin-2-yl)methyl]-N-methylpiperidin-4-amine is sourced from PubChem (CID 114430948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).