N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine

C19H38N2 — CID 6480625

IUPACN-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCC(C)=CCC[C@@H](C)CCNC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C19H38N2/c1-15(2)9-8-10-16(3)11-12-20-17-13-18(4,5)21-19(6,7)14-17/h9,16-17,20-21H,8,10-14H2,1-7H3/t16-/m1/s1
InChIKeyJEDFQOBJLTYPSS-MRXNPFEDSA-N
MW294.53 g/mol
LogP4.66
Rot. Bonds7

About N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine

N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine (PubChem CID 6480625) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine
PubChem CID6480625
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC NameN-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCC(C)=CCC[C@@H](C)CCNC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C19H38N2/c1-15(2)9-8-10-16(3)11-12-20-17-13-18(4,5)21-19(6,7)14-17/h9,16-17,20-21H,8,10-14H2,1-7H3/t16-/m1/s1
InChIKeyJEDFQOBJLTYPSS-MRXNPFEDSA-N
XLogP4.66
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine?
The IUPAC name of N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine (CID 6480625) is N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine.
What is the SMILES notation for N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine?
The canonical SMILES for N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine is CC(C)=CCC[C@@H](C)CCNC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine?
The InChIKey is JEDFQOBJLTYPSS-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H38N2/c1-15(2)9-8-10-16(3)11-12-20-17-13-18(4,5)21-19(6,7)14-17/h9,16-17,20-21H,8,10-14H2,1-7H3/t16-/m1/s1.
What are the key properties of N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine?
N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine has a molecular weight of 294.53 g/mol, XLogP of 4.66, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-3,7-dimethyloct-6-enyl]-2,2,6,6-tetramethylpiperidin-4-amine is sourced from PubChem (CID 6480625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).