N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide

C13H21NO2 — CID 82745104

IUPACN-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide
SMILESCC1OCCC1N(C)C(=O)C1CC2CC2C1
InChIInChI=1S/C13H21NO2/c1-8-12(3-4-16-8)14(2)13(15)11-6-9-5-10(9)7-11/h8-12H,3-7H2,1-2H3
InChIKeyGHJHNVPSYQCOKJ-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.67
Rot. Bonds2

About N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide

N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide (PubChem CID 82745104) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide
PubChem CID82745104
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide
SMILESCC1OCCC1N(C)C(=O)C1CC2CC2C1
InChIInChI=1S/C13H21NO2/c1-8-12(3-4-16-8)14(2)13(15)11-6-9-5-10(9)7-11/h8-12H,3-7H2,1-2H3
InChIKeyGHJHNVPSYQCOKJ-UHFFFAOYSA-N
XLogP1.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide?
The IUPAC name of N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide (CID 82745104) is N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide.
What is the SMILES notation for N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide?
The canonical SMILES for N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide is CC1OCCC1N(C)C(=O)C1CC2CC2C1.
What is the InChIKey of N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide?
The InChIKey is GHJHNVPSYQCOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-8-12(3-4-16-8)14(2)13(15)11-6-9-5-10(9)7-11/h8-12H,3-7H2,1-2H3.
What are the key properties of N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide?
N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide has a molecular weight of 223.32 g/mol, XLogP of 1.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methyloxolan-3-yl)bicyclo[3.1.0]hexane-3-carboxamide is sourced from PubChem (CID 82745104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).