N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine

C19H40N4 — CID 175318158

IUPACN-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine
SMILESCCCCCCNN1C(C)(C)CC(N2CCNCC2)CC1(C)C
InChIInChI=1S/C19H40N4/c1-6-7-8-9-10-21-23-18(2,3)15-17(16-19(23,4)5)22-13-11-20-12-14-22/h17,20-21H,6-16H2,1-5H3
InChIKeyBZVUFRBDDWFNBP-UHFFFAOYSA-N
MW324.56 g/mol
LogP3.00
Rot. Bonds7

About N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine

N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine (PubChem CID 175318158) has the molecular formula C19H40N4 and a molecular weight of 324.56 g/mol. Its IUPAC name is N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine.

Molecular Properties

Compound NameN-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine
PubChem CID175318158
Molecular FormulaC19H40N4
Molecular Weight324.56 g/mol
Exact Mass324.33
IUPAC NameN-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine
SMILESCCCCCCNN1C(C)(C)CC(N2CCNCC2)CC1(C)C
InChIInChI=1S/C19H40N4/c1-6-7-8-9-10-21-23-18(2,3)15-17(16-19(23,4)5)22-13-11-20-12-14-22/h17,20-21H,6-16H2,1-5H3
InChIKeyBZVUFRBDDWFNBP-UHFFFAOYSA-N
XLogP3.00
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.56
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-pentadecylpiperazin-1-amine
CID 11690308
1-[6-[(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)amino]hexylamino]-2,2,6,6-tetramethylpiperidin-4-ol
CID 139605403
1-N-docosylpiperazine-1,2-diamine
CID 91098559
N-(3-piperazin-1-ylpropyl)hexan-1-amine
CID 135182222
N-(2-piperazin-1-ylethyl)octan-1-amine
CID 115568684
N-pentyl-6-piperazin-1-ylhexan-1-amine
CID 54403619
N-(2-piperazin-1-ylethyl)tetradecan-1-amine
CID 22706682
N-octadecylaziridin-1-amine
CID 56627527
N-octylaziridin-1-amine
CID 175164558
CID 101119102
CID 101119102
1-(3,3-difluorocyclobutyl)piperazine
CID 126739503
N-hexyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548728

Frequently Asked Questions

What is the IUPAC name of N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine?
The IUPAC name of N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine (CID 175318158) is N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine.
What is the SMILES notation for N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine?
The canonical SMILES for N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine is CCCCCCNN1C(C)(C)CC(N2CCNCC2)CC1(C)C.
What is the InChIKey of N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine?
The InChIKey is BZVUFRBDDWFNBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N4/c1-6-7-8-9-10-21-23-18(2,3)15-17(16-19(23,4)5)22-13-11-20-12-14-22/h17,20-21H,6-16H2,1-5H3.
What are the key properties of N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine?
N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine has a molecular weight of 324.56 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-2,2,6,6-tetramethyl-4-piperazin-1-ylpiperidin-1-amine is sourced from PubChem (CID 175318158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).