N-[(1R,2R)-2-aminocyclohexyl]nonanamide

C15H30N2O — CID 103805764

IUPACN-[(1R,2R)-2-aminocyclohexyl]nonanamide
SMILESCCCCCCCCC(=O)N[C@@H]1CCCC[C@H]1N
InChIInChI=1S/C15H30N2O/c1-2-3-4-5-6-7-12-15(18)17-14-11-9-8-10-13(14)16/h13-14H,2-12,16H2,1H3,(H,17,18)/t13-,14-/m1/s1
InChIKeyDBNHVQDYPUAWEJ-ZIAGYGMSSA-N
MW254.42 g/mol
LogP3.12
Rot. Bonds8

About N-[(1R,2R)-2-aminocyclohexyl]nonanamide

N-[(1R,2R)-2-aminocyclohexyl]nonanamide (PubChem CID 103805764) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[(1R,2R)-2-aminocyclohexyl]nonanamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-aminocyclohexyl]nonanamide
PubChem CID103805764
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[(1R,2R)-2-aminocyclohexyl]nonanamide
SMILESCCCCCCCCC(=O)N[C@@H]1CCCC[C@H]1N
InChIInChI=1S/C15H30N2O/c1-2-3-4-5-6-7-12-15(18)17-14-11-9-8-10-13(14)16/h13-14H,2-12,16H2,1H3,(H,17,18)/t13-,14-/m1/s1
InChIKeyDBNHVQDYPUAWEJ-ZIAGYGMSSA-N
XLogP3.12
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.12
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

N-[(1R,2R)-2-aminocyclohexyl]decanamide
CID 103805740
N-[2-(dodecanoylamino)cyclohexyl]dodecanamide
CID 10299379
N-[(1R,2R)-2-acetamidocyclohexyl]dodecanamide
CID 158939000
N-(2-bromocyclohexyl)heptanamide
CID 114754026
N-[2-(hydroxymethyl)cyclopentyl]nonanamide
CID 103774038
N-(2-aminocyclohexyl)propanamide
CID 61036997
N-[2-(chloromethyl)cyclopentyl]nonanamide
CID 114179441
N-(2-chlorocyclopentyl)nonanamide
CID 106443674
N-(2-chlorocyclopentyl)dodecanamide
CID 106444076
N-(2-aminocycloheptyl)hept-6-ynamide
CID 114028619
N-(2,3-dimethylcyclohexyl)tridecanamide
CID 57307251
N-[(1R,2R)-2-aminocyclohexyl]-3-ethoxypropanamide
CID 103805745

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-aminocyclohexyl]nonanamide?
The IUPAC name of N-[(1R,2R)-2-aminocyclohexyl]nonanamide (CID 103805764) is N-[(1R,2R)-2-aminocyclohexyl]nonanamide.
What is the SMILES notation for N-[(1R,2R)-2-aminocyclohexyl]nonanamide?
The canonical SMILES for N-[(1R,2R)-2-aminocyclohexyl]nonanamide is CCCCCCCCC(=O)N[C@@H]1CCCC[C@H]1N.
What is the InChIKey of N-[(1R,2R)-2-aminocyclohexyl]nonanamide?
The InChIKey is DBNHVQDYPUAWEJ-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-3-4-5-6-7-12-15(18)17-14-11-9-8-10-13(14)16/h13-14H,2-12,16H2,1H3,(H,17,18)/t13-,14-/m1/s1.
What are the key properties of N-[(1R,2R)-2-aminocyclohexyl]nonanamide?
N-[(1R,2R)-2-aminocyclohexyl]nonanamide has a molecular weight of 254.42 g/mol, XLogP of 3.12, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-aminocyclohexyl]nonanamide is sourced from PubChem (CID 103805764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).