4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde

C11H22N2O — CID 143834965

IUPAC4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde
SMILESCCNCC1(CC)CCN(C=O)CC1
InChIInChI=1S/C11H22N2O/c1-3-11(9-12-4-2)5-7-13(10-14)8-6-11/h10,12H,3-9H2,1-2H3
InChIKeyFOTGAINGPCHPPQ-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.24
Rot. Bonds5

About 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde

4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde (PubChem CID 143834965) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde.

Molecular Properties

Compound Name4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde
PubChem CID143834965
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde
SMILESCCNCC1(CC)CCN(C=O)CC1
InChIInChI=1S/C11H22N2O/c1-3-11(9-12-4-2)5-7-13(10-14)8-6-11/h10,12H,3-9H2,1-2H3
InChIKeyFOTGAINGPCHPPQ-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[(1-ethylcyclobutyl)methyl]ethanamine
CID 65194759
4-ethyl-4-methylpiperidine-1-carbaldehyde
CID 64992637
N-[(4-ethyloxan-4-yl)methyl]ethanamine
CID 62907127
ethane;N-[(4-ethylpiperidin-4-yl)methyl]ethanamine
CID 143578873
N-[(1-ethylcyclobutyl)methyl]-3-methylbut-2-en-1-amine
CID 106547276
4-hydroxy-4-phosphanylpiperidine-1-carbaldehyde
CID 143380034
1-(4-ethyl-1-methylpiperidin-4-yl)-N-methylmethanamine
CID 83635773
ethane;N-ethyl-2-(4-ethyl-1-methylpiperidin-4-yl)ethanamine
CID 177188375
N-[[1-[(4-ethylpiperazin-1-yl)methyl]cyclopentyl]methyl]ethanamine
CID 62263344
N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine
CID 106457012
N-[[1-(ethoxymethyl)cyclopentyl]methyl]ethanamine
CID 103984503
4-tert-butyl-4-methylpiperidine-1-carbaldehyde
CID 156749838

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde?
The IUPAC name of 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde (CID 143834965) is 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde.
What is the SMILES notation for 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde?
The canonical SMILES for 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde is CCNCC1(CC)CCN(C=O)CC1.
What is the InChIKey of 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde?
The InChIKey is FOTGAINGPCHPPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-11(9-12-4-2)5-7-13(10-14)8-6-11/h10,12H,3-9H2,1-2H3.
What are the key properties of 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde?
4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde has a molecular weight of 198.31 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-(ethylaminomethyl)piperidine-1-carbaldehyde is sourced from PubChem (CID 143834965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).