N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide

C11H21NO2 — CID 103919117

IUPACN-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCCCCCCO
InChIInChI=1S/C11H21NO2/c1-9-8-10(9)11(14)12-6-4-2-3-5-7-13/h9-10,13H,2-8H2,1H3,(H,12,14)
InChIKeyVWZRZMCYYZQMIE-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.31
Rot. Bonds7

About N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide

N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 103919117) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide
PubChem CID103919117
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCCCCCCO
InChIInChI=1S/C11H21NO2/c1-9-8-10(9)11(14)12-6-4-2-3-5-7-13/h9-10,13H,2-8H2,1H3,(H,12,14)
InChIKeyVWZRZMCYYZQMIE-UHFFFAOYSA-N
XLogP1.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.31
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-(3-aminopropyl)-2-methylcyclopropane-1-carboxamide
CID 24711673
4-[(2-methylcyclopropanecarbonyl)amino]butanoic acid
CID 16772815
cis-(1S,2R)-2-(6-hydroxyhexylcarbamoyl)cyclopentane-1-carboxylic acid
CID 114093307
cis-(1R,2S)-2-methyl-N-propylcyclopropane-1-carboxamide
CID 95357811
N-(6-hydroxyhexyl)-4-methylcyclohexane-1-carboxamide
CID 113351776
N-(3-cyanopropyl)-2-methylcyclopropane-1-carboxamide
CID 62667763
N-(3-hydroxypropyl)-4-methylpyrrolidine-3-carboxamide
CID 63715754
2-methyl-N-[2-(methylamino)ethyl]cyclopropane-1-carboxamide
CID 62657204
N-(6-hydroxyhexyl)-7-azabicyclo[2.2.1]heptane-2-carboxamide
CID 107842560
N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide
CID 43350590
N-(4-hydroxybutyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 106843014
N-(6-hydroxyhexyl)cyclopentanecarboxamide
CID 70973936

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide (CID 103919117) is N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NCCCCCCO.
What is the InChIKey of N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is VWZRZMCYYZQMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9-8-10(9)11(14)12-6-4-2-3-5-7-13/h9-10,13H,2-8H2,1H3,(H,12,14).
What are the key properties of N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide?
N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 199.29 g/mol, XLogP of 1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 103919117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).