1-tert-butyl-N-cyclooctylpiperidin-4-amine

C17H34N2 — CID 54866557

IUPAC1-tert-butyl-N-cyclooctylpiperidin-4-amine
SMILESCC(C)(C)N1CCC(NC2CCCCCCC2)CC1
InChIInChI=1S/C17H34N2/c1-17(2,3)19-13-11-16(12-14-19)18-15-9-7-5-4-6-8-10-15/h15-16,18H,4-14H2,1-3H3
InChIKeyPVCAOYBXNBWSAU-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.95
Rot. Bonds2

About 1-tert-butyl-N-cyclooctylpiperidin-4-amine

1-tert-butyl-N-cyclooctylpiperidin-4-amine (PubChem CID 54866557) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-tert-butyl-N-cyclooctylpiperidin-4-amine.

Molecular Properties

Compound Name1-tert-butyl-N-cyclooctylpiperidin-4-amine
PubChem CID54866557
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-tert-butyl-N-cyclooctylpiperidin-4-amine
SMILESCC(C)(C)N1CCC(NC2CCCCCCC2)CC1
InChIInChI=1S/C17H34N2/c1-17(2,3)19-13-11-16(12-14-19)18-15-9-7-5-4-6-8-10-15/h15-16,18H,4-14H2,1-3H3
InChIKeyPVCAOYBXNBWSAU-UHFFFAOYSA-N
XLogP3.95
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-tert-butyl-N-cyclooctylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-tert-butyl-N-(4,4-dimethylcycloheptyl)piperidin-4-amine
CID 65083690
1-tert-butyl-N-spiro[4.5]decan-8-ylpiperidin-4-amine
CID 114817492
1-tert-butyl-N-(2-methylcyclopentyl)piperidin-4-amine
CID 65045786
(1-tert-butylpiperidin-4-yl)hydrazine
CID 21097250
N-cyclohexylcyclohexanamine;ethane
CID 67925930
N-(1-tert-butylpiperidin-4-yl)-1-(1-methylsulfanylethyl)piperidin-4-amine
CID 146526516
1-tert-butyl-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)piperidin-4-amine
CID 115727495
N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
CID 53408550
N-cyclopropylcyclododecanamine
CID 16776852
4-N-tert-butyl-1-N-cyclohexylcyclohexane-1,4-diamine
CID 58707395
N-[(3aS,4R,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran-4-yl]-1-tert-butylpiperidin-4-amine
CID 100901011
1,6-ditert-butyl-1,6-diazacycloundecane
CID 90712737

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-N-cyclooctylpiperidin-4-amine?
The IUPAC name of 1-tert-butyl-N-cyclooctylpiperidin-4-amine (CID 54866557) is 1-tert-butyl-N-cyclooctylpiperidin-4-amine.
What is the SMILES notation for 1-tert-butyl-N-cyclooctylpiperidin-4-amine?
The canonical SMILES for 1-tert-butyl-N-cyclooctylpiperidin-4-amine is CC(C)(C)N1CCC(NC2CCCCCCC2)CC1.
What is the InChIKey of 1-tert-butyl-N-cyclooctylpiperidin-4-amine?
The InChIKey is PVCAOYBXNBWSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-17(2,3)19-13-11-16(12-14-19)18-15-9-7-5-4-6-8-10-15/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 1-tert-butyl-N-cyclooctylpiperidin-4-amine?
1-tert-butyl-N-cyclooctylpiperidin-4-amine has a molecular weight of 266.47 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-N-cyclooctylpiperidin-4-amine is sourced from PubChem (CID 54866557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).