N-(azetidin-3-yl)-N-methylhexanamide

C10H20N2O — CID 66186842

IUPACN-(azetidin-3-yl)-N-methylhexanamide
SMILESCCCCCC(=O)N(C)C1CNC1
InChIInChI=1S/C10H20N2O/c1-3-4-5-6-10(13)12(2)9-7-11-8-9/h9,11H,3-8H2,1-2H3
InChIKeyNORVKNLTXYBMTL-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.00
Rot. Bonds5

About N-(azetidin-3-yl)-N-methylhexanamide

N-(azetidin-3-yl)-N-methylhexanamide (PubChem CID 66186842) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-methylhexanamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-methylhexanamide
PubChem CID66186842
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-(azetidin-3-yl)-N-methylhexanamide
SMILESCCCCCC(=O)N(C)C1CNC1
InChIInChI=1S/C10H20N2O/c1-3-4-5-6-10(13)12(2)9-7-11-8-9/h9,11H,3-8H2,1-2H3
InChIKeyNORVKNLTXYBMTL-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.00
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-(4-aminocyclohexyl)-N-methyloctanamide
CID 79121707
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylpentanediamide
CID 119550914
4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide
CID 119551610
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide
CID 61232017
4-(dipropylamino)-N-methyl-N-pyrrolidin-3-ylbutanamide;dihydrochloride
CID 119551609
N-methyl-N-nonylazetidin-3-amine
CID 66186670
N-heptyl-N-methylazetidin-3-amine
CID 66185882
N-(azetidin-3-yl)-3-cyclohexyl-N-methylpropanamide
CID 66185701
2-[azetidin-3-yl(methyl)amino]-2-oxoethanesulfinic acid
CID 84664064
N',N'-diethyl-N-methyl-N-pyrrolidin-3-ylbutanediamide
CID 119554222
N-piperidin-4-yl-N-propylhexanamide
CID 60807623

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N-methylhexanamide?
The IUPAC name of N-(azetidin-3-yl)-N-methylhexanamide (CID 66186842) is N-(azetidin-3-yl)-N-methylhexanamide.
What is the SMILES notation for N-(azetidin-3-yl)-N-methylhexanamide?
The canonical SMILES for N-(azetidin-3-yl)-N-methylhexanamide is CCCCCC(=O)N(C)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-N-methylhexanamide?
The InChIKey is NORVKNLTXYBMTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-4-5-6-10(13)12(2)9-7-11-8-9/h9,11H,3-8H2,1-2H3.
What are the key properties of N-(azetidin-3-yl)-N-methylhexanamide?
N-(azetidin-3-yl)-N-methylhexanamide has a molecular weight of 184.28 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N-methylhexanamide is sourced from PubChem (CID 66186842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).