(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide

C14H24N2O — CID 113304839

IUPAC(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide
SMILESCCCC[C@H](N)C(=O)NC1C2C3CCC(C3)C12
InChIInChI=1S/C14H24N2O/c1-2-3-4-10(15)14(17)16-13-11-8-5-6-9(7-8)12(11)13/h8-13H,2-7,15H2,1H3,(H,16,17)/t8?,9?,10-,11?,12?,13?/m0/s1
InChIKeyYFBNIIQQUQXOOR-GGEAOBHFSA-N
MW236.36 g/mol
LogP1.66
Rot. Bonds5

About (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide

(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide (PubChem CID 113304839) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide
PubChem CID113304839
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide
SMILESCCCC[C@H](N)C(=O)NC1C2C3CCC(C3)C12
InChIInChI=1S/C14H24N2O/c1-2-3-4-10(15)14(17)16-13-11-8-5-6-9(7-8)12(11)13/h8-13H,2-7,15H2,1H3,(H,16,17)/t8?,9?,10-,11?,12?,13?/m0/s1
InChIKeyYFBNIIQQUQXOOR-GGEAOBHFSA-N
XLogP1.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide with MolForge

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Related Compounds

(2S)-2-amino-N-cycloheptylhexanamide
CID 103830902
2-amino-N-[4-(trifluoromethyl)cyclohexyl]hexanamide
CID 54928386
(2S)-2-amino-3-methyl-N-(3-tricyclo[3.2.1.02,4]octanyl)pentanamide
CID 113315069
(2S)-2-amino-N-(3,4-dimethylcyclohexyl)hexanamide
CID 107145708
(2S)-2-amino-3-methyl-N-(3-tricyclo[3.2.1.02,4]octanyl)butanamide
CID 103798202
2-(2-aminohexanoylamino)cyclohexane-1-carboxylic acid
CID 64817389
(2S)-2-amino-N-(2,2-dimethylcyclopentyl)hexanamide
CID 103831777
2-amino-N-(2-methylcyclopentyl)hexanamide
CID 63281748
2-amino-N-(oxolan-3-yl)hexanamide
CID 80713232
(2S)-2-amino-N-(2,2-dicyclopropylethyl)hexanamide
CID 113304830
3-[(2-amino-5-methoxypentanoyl)amino]bicyclo[2.2.1]heptane-2-carboxylic acid
CID 81101695
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)hexanamide
CID 107146718

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide?
The IUPAC name of (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide (CID 113304839) is (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide.
What is the SMILES notation for (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide?
The canonical SMILES for (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide is CCCC[C@H](N)C(=O)NC1C2C3CCC(C3)C12.
What is the InChIKey of (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide?
The InChIKey is YFBNIIQQUQXOOR-GGEAOBHFSA-N. The full InChI is InChI=1S/C14H24N2O/c1-2-3-4-10(15)14(17)16-13-11-8-5-6-9(7-8)12(11)13/h8-13H,2-7,15H2,1H3,(H,16,17)/t8?,9?,10-,11?,12?,13?/m0/s1.
What are the key properties of (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide?
(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide has a molecular weight of 236.36 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide is sourced from PubChem (CID 113304839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).