N,N-diethyl-1-piperidin-4-ylpropan-2-amine

C12H26N2 — CID 105451801

IUPACN,N-diethyl-1-piperidin-4-ylpropan-2-amine
SMILESCCN(CC)C(C)CC1CCNCC1
InChIInChI=1S/C12H26N2/c1-4-14(5-2)11(3)10-12-6-8-13-9-7-12/h11-13H,4-10H2,1-3H3
InChIKeyORONUCZUXSXZHG-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.11
Rot. Bonds5

About N,N-diethyl-1-piperidin-4-ylpropan-2-amine

N,N-diethyl-1-piperidin-4-ylpropan-2-amine (PubChem CID 105451801) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N,N-diethyl-1-piperidin-4-ylpropan-2-amine.

Molecular Properties

Compound NameN,N-diethyl-1-piperidin-4-ylpropan-2-amine
PubChem CID105451801
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN,N-diethyl-1-piperidin-4-ylpropan-2-amine
SMILESCCN(CC)C(C)CC1CCNCC1
InChIInChI=1S/C12H26N2/c1-4-14(5-2)11(3)10-12-6-8-13-9-7-12/h11-13H,4-10H2,1-3H3
InChIKeyORONUCZUXSXZHG-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-piperidin-4-ylpropan-2-amine?
The IUPAC name of N,N-diethyl-1-piperidin-4-ylpropan-2-amine (CID 105451801) is N,N-diethyl-1-piperidin-4-ylpropan-2-amine.
What is the SMILES notation for N,N-diethyl-1-piperidin-4-ylpropan-2-amine?
The canonical SMILES for N,N-diethyl-1-piperidin-4-ylpropan-2-amine is CCN(CC)C(C)CC1CCNCC1.
What is the InChIKey of N,N-diethyl-1-piperidin-4-ylpropan-2-amine?
The InChIKey is ORONUCZUXSXZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-14(5-2)11(3)10-12-6-8-13-9-7-12/h11-13H,4-10H2,1-3H3.
What are the key properties of N,N-diethyl-1-piperidin-4-ylpropan-2-amine?
N,N-diethyl-1-piperidin-4-ylpropan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-piperidin-4-ylpropan-2-amine is sourced from PubChem (CID 105451801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).