N-(4-aminocyclohexyl)-N-methyloctanamide

C15H30N2O — CID 79121707

IUPACN-(4-aminocyclohexyl)-N-methyloctanamide
SMILESCCCCCCCC(=O)N(C)C1CCC(N)CC1
InChIInChI=1S/C15H30N2O/c1-3-4-5-6-7-8-15(18)17(2)14-11-9-13(16)10-12-14/h13-14H,3-12,16H2,1-2H3
InChIKeyYCILDBACAPZMCN-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.08
Rot. Bonds7

About N-(4-aminocyclohexyl)-N-methyloctanamide

N-(4-aminocyclohexyl)-N-methyloctanamide (PubChem CID 79121707) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-methyloctanamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-methyloctanamide
PubChem CID79121707
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(4-aminocyclohexyl)-N-methyloctanamide
SMILESCCCCCCCC(=O)N(C)C1CCC(N)CC1
InChIInChI=1S/C15H30N2O/c1-3-4-5-6-7-8-15(18)17(2)14-11-9-13(16)10-12-14/h13-14H,3-12,16H2,1-2H3
InChIKeyYCILDBACAPZMCN-UHFFFAOYSA-N
XLogP3.08
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N-piperidin-4-ylheptanamide
CID 115736784
N-(azetidin-3-yl)-N-methylhexanamide
CID 66186842
N-(4-aminocyclohexyl)-3-cyclobutyl-N-methylpropanamide
CID 115277537
5-chloro-N-cyclopropyl-N-methylpentanamide
CID 43264877
6-amino-N-cyclopentyl-N-methylhexanamide
CID 43267226
N-cyclopropyl-4-hydroxy-N-methylbutanamide
CID 79203211
ethyl N-(4-aminocyclohexyl)-N-methylcarbamate
CID 79121309
7-amino-N-cycloheptyl-N-methylheptanamide
CID 43614064
7-amino-N-cyclooctyl-N-methylheptanamide
CID 119763844
N-methyl-N-[4-(propylamino)cyclohexyl]pentanamide
CID 79122715
N-(3-aminocyclohexyl)-N-octanoyloctanamide
CID 142723114
N-(3-aminopropyl)-N-cyclopropyloctanamide
CID 43136708

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-methyloctanamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-methyloctanamide (CID 79121707) is N-(4-aminocyclohexyl)-N-methyloctanamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-methyloctanamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-methyloctanamide is CCCCCCCC(=O)N(C)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-methyloctanamide?
The InChIKey is YCILDBACAPZMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-4-5-6-7-8-15(18)17(2)14-11-9-13(16)10-12-14/h13-14H,3-12,16H2,1-2H3.
What are the key properties of N-(4-aminocyclohexyl)-N-methyloctanamide?
N-(4-aminocyclohexyl)-N-methyloctanamide has a molecular weight of 254.42 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-methyloctanamide is sourced from PubChem (CID 79121707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).