N-ethyl-1-(7-methyloctyl)piperidin-4-amine

C16H34N2 — CID 114004129

IUPACN-ethyl-1-(7-methyloctyl)piperidin-4-amine
SMILESCCNC1CCN(CCCCCCC(C)C)CC1
InChIInChI=1S/C16H34N2/c1-4-17-16-10-13-18(14-11-16)12-8-6-5-7-9-15(2)3/h15-17H,4-14H2,1-3H3
InChIKeyQEZWNXUMAYUNLD-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.67
Rot. Bonds9

About N-ethyl-1-(7-methyloctyl)piperidin-4-amine

N-ethyl-1-(7-methyloctyl)piperidin-4-amine (PubChem CID 114004129) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N-ethyl-1-(7-methyloctyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(7-methyloctyl)piperidin-4-amine
PubChem CID114004129
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN-ethyl-1-(7-methyloctyl)piperidin-4-amine
SMILESCCNC1CCN(CCCCCCC(C)C)CC1
InChIInChI=1S/C16H34N2/c1-4-17-16-10-13-18(14-11-16)12-8-6-5-7-9-15(2)3/h15-17H,4-14H2,1-3H3
InChIKeyQEZWNXUMAYUNLD-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-dodecyl-N-ethylpiperidin-4-amine
CID 63400728
N-ethyl-1-pentylpiperidin-4-amine
CID 43315098
1-butyl-N-ethylpiperidin-4-amine
CID 43314967
ethane;4-ethyl-1-(6-methylheptyl)piperidine
CID 170614915
N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
CID 107910858
4-butoxy-1-(5-methylhexyl)piperidine
CID 156530555
N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine
CID 115512946
1-(3-butoxypropyl)-N-ethylpiperidin-4-amine
CID 113481126
1-dodecyl-N-methylpiperidin-4-amine
CID 63400682
4-chloro-1-(4-methylpentyl)piperidine
CID 83168582
N-[[1-(4-methylpentyl)piperidin-4-yl]methyl]ethanamine
CID 83158561
3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine
CID 107815366

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(7-methyloctyl)piperidin-4-amine?
The IUPAC name of N-ethyl-1-(7-methyloctyl)piperidin-4-amine (CID 114004129) is N-ethyl-1-(7-methyloctyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(7-methyloctyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-1-(7-methyloctyl)piperidin-4-amine is CCNC1CCN(CCCCCCC(C)C)CC1.
What is the InChIKey of N-ethyl-1-(7-methyloctyl)piperidin-4-amine?
The InChIKey is QEZWNXUMAYUNLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-17-16-10-13-18(14-11-16)12-8-6-5-7-9-15(2)3/h15-17H,4-14H2,1-3H3.
What are the key properties of N-ethyl-1-(7-methyloctyl)piperidin-4-amine?
N-ethyl-1-(7-methyloctyl)piperidin-4-amine has a molecular weight of 254.46 g/mol, XLogP of 3.67, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(7-methyloctyl)piperidin-4-amine is sourced from PubChem (CID 114004129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).