6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide

C16H28N2O — CID 43710195

IUPAC6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide
SMILESNCCCCCC(=O)NC1CC2CC1C1CCCC21
InChIInChI=1S/C16H28N2O/c17-8-3-1-2-7-16(19)18-15-10-11-9-14(15)13-6-4-5-12(11)13/h11-15H,1-10,17H2,(H,18,19)
InChIKeyXNNIIMJJPBYKFD-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.45
Rot. Bonds6

About 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide

6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide (PubChem CID 43710195) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide.

Molecular Properties

Compound Name6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide
PubChem CID43710195
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide
SMILESNCCCCCC(=O)NC1CC2CC1C1CCCC21
InChIInChI=1S/C16H28N2O/c17-8-3-1-2-7-16(19)18-15-10-11-9-14(15)13-6-4-5-12(11)13/h11-15H,1-10,17H2,(H,18,19)
InChIKeyXNNIIMJJPBYKFD-UHFFFAOYSA-N
XLogP2.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)heptanamide;hydrochloride
CID 119729134
6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide
CID 107221663
3-(2-methylpropylsulfonyl)-N-[(1R,2S,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]propanamide
CID 124729850
3-(2-methylpropylsulfonyl)-N-[(1R,2S,6R,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]propanamide
CID 124729848
2-tert-butylsulfanyl-N-(8-tricyclo[5.2.1.02,6]decanyl)acetamide
CID 78858492
7-amino-N-(1-azabicyclo[2.2.2]octan-3-yl)heptanamide
CID 24703971
7-amino-N-(3-methylcyclohexyl)heptanamide
CID 43317968
3-amino-2,2,3-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)butanamide
CID 65264411
N-[(1R,2S,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopentanecarboxamide
CID 124785473
2-amino-2-ethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)butanamide
CID 79809442
6-amino-N-[2-(trifluoromethyl)cyclohexyl]hexanamide
CID 43712731
2-cyclopent-2-en-1-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)acetamide
CID 43066745

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide?
The IUPAC name of 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide (CID 43710195) is 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide.
What is the SMILES notation for 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide?
The canonical SMILES for 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide is NCCCCCC(=O)NC1CC2CC1C1CCCC21.
What is the InChIKey of 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide?
The InChIKey is XNNIIMJJPBYKFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c17-8-3-1-2-7-16(19)18-15-10-11-9-14(15)13-6-4-5-12(11)13/h11-15H,1-10,17H2,(H,18,19).
What are the key properties of 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide?
6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide has a molecular weight of 264.41 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(8-tricyclo[5.2.1.02,6]decanyl)hexanamide is sourced from PubChem (CID 43710195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).