1-methyl-1-(nitrosomethyl)cyclopentane

C7H13NO — CID 88905050

IUPAC1-methyl-1-(nitrosomethyl)cyclopentane
SMILESCC1(CN=O)CCCC1
InChIInChI=1S/C7H13NO/c1-7(6-8-9)4-2-3-5-7/h2-6H2,1H3
InChIKeyIITDSQPHEIODEL-UHFFFAOYSA-N
MW127.19 g/mol
LogP2.33
Rot. Bonds2

About 1-methyl-1-(nitrosomethyl)cyclopentane

1-methyl-1-(nitrosomethyl)cyclopentane (PubChem CID 88905050) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 1-methyl-1-(nitrosomethyl)cyclopentane.

Molecular Properties

Compound Name1-methyl-1-(nitrosomethyl)cyclopentane
PubChem CID88905050
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name1-methyl-1-(nitrosomethyl)cyclopentane
SMILESCC1(CN=O)CCCC1
InChIInChI=1S/C7H13NO/c1-7(6-8-9)4-2-3-5-7/h2-6H2,1H3
InChIKeyIITDSQPHEIODEL-UHFFFAOYSA-N
XLogP2.33
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-(nitrosomethyl)cyclopentane?
The IUPAC name of 1-methyl-1-(nitrosomethyl)cyclopentane (CID 88905050) is 1-methyl-1-(nitrosomethyl)cyclopentane.
What is the SMILES notation for 1-methyl-1-(nitrosomethyl)cyclopentane?
The canonical SMILES for 1-methyl-1-(nitrosomethyl)cyclopentane is CC1(CN=O)CCCC1.
What is the InChIKey of 1-methyl-1-(nitrosomethyl)cyclopentane?
The InChIKey is IITDSQPHEIODEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-7(6-8-9)4-2-3-5-7/h2-6H2,1H3.
What are the key properties of 1-methyl-1-(nitrosomethyl)cyclopentane?
1-methyl-1-(nitrosomethyl)cyclopentane has a molecular weight of 127.19 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-(nitrosomethyl)cyclopentane is sourced from PubChem (CID 88905050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).