3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine

C18H38N2 — CID 107815366

IUPAC3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCCCCCC(C)C)CC1C
InChIInChI=1S/C18H38N2/c1-5-12-19-18-11-14-20(15-17(18)4)13-9-7-6-8-10-16(2)3/h16-19H,5-15H2,1-4H3
InChIKeyQLRMGFNILYWSPI-UHFFFAOYSA-N
MW282.52 g/mol
LogP4.30
Rot. Bonds10

About 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine

3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine (PubChem CID 107815366) has the molecular formula C18H38N2 and a molecular weight of 282.52 g/mol. Its IUPAC name is 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine
PubChem CID107815366
Molecular FormulaC18H38N2
Molecular Weight282.52 g/mol
Exact Mass282.30
IUPAC Name3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CCCCCCC(C)C)CC1C
InChIInChI=1S/C18H38N2/c1-5-12-19-18-11-14-20(15-17(18)4)13-9-7-6-8-10-16(2)3/h16-19H,5-15H2,1-4H3
InChIKeyQLRMGFNILYWSPI-UHFFFAOYSA-N
XLogP4.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.52
LogP ≤ 54.30
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-(2-cyclopentyloxyethyl)-3-methyl-N-propylpiperidin-4-amine
CID 63828595
1-[2-(dimethylamino)ethyl]-3-methyl-N-propylpiperidin-4-amine
CID 114499538
3-methyl-N-propyl-1-(2,3,3-trimethylbutyl)piperidin-4-amine
CID 83143298
N-cyclopropyl-3-[3-methyl-4-(propylamino)piperidin-1-yl]propanamide
CID 114499450
N-ethyl-1-(7-methyloctyl)piperidin-4-amine
CID 114004129
1,3-dimethyl-N-(3-methylbutyl)piperidin-4-amine
CID 115705278
N-ethyl-3-methyl-1-(3-pyrrolidin-1-ylpropyl)piperidin-4-amine
CID 114499328
3-methyl-1-[(3-methylcyclopentyl)methyl]-N-propylpiperidin-4-amine
CID 107413462
1-(3-methylbutyl)-N-propylpyrrolidin-3-amine
CID 43314968
4-bromo-3-methyl-1-(4-methylpentyl)piperidine
CID 114682378
ethane;4-ethyl-1-(6-methylheptyl)piperidine
CID 170614915
4-butoxy-1-(5-methylhexyl)piperidine
CID 156530555

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine?
The IUPAC name of 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine (CID 107815366) is 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine?
The canonical SMILES for 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine is CCCNC1CCN(CCCCCCC(C)C)CC1C.
What is the InChIKey of 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine?
The InChIKey is QLRMGFNILYWSPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2/c1-5-12-19-18-11-14-20(15-17(18)4)13-9-7-6-8-10-16(2)3/h16-19H,5-15H2,1-4H3.
What are the key properties of 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine?
3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine has a molecular weight of 282.52 g/mol, XLogP of 4.30, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(7-methyloctyl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 107815366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).