2-butyl-1-methyl-1-nitrosocyclopropane

C8H15NO — CID 88564371

IUPAC2-butyl-1-methyl-1-nitrosocyclopropane
SMILESCCCCC1CC1(C)N=O
InChIInChI=1S/C8H15NO/c1-3-4-5-7-6-8(7,2)9-10/h7H,3-6H2,1-2H3
InChIKeyBYXDXNWHIILCST-UHFFFAOYSA-N
MW141.21 g/mol
LogP2.72
Rot. Bonds4

About 2-butyl-1-methyl-1-nitrosocyclopropane

2-butyl-1-methyl-1-nitrosocyclopropane (PubChem CID 88564371) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-butyl-1-methyl-1-nitrosocyclopropane.

Molecular Properties

Compound Name2-butyl-1-methyl-1-nitrosocyclopropane
PubChem CID88564371
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-butyl-1-methyl-1-nitrosocyclopropane
SMILESCCCCC1CC1(C)N=O
InChIInChI=1S/C8H15NO/c1-3-4-5-7-6-8(7,2)9-10/h7H,3-6H2,1-2H3
InChIKeyBYXDXNWHIILCST-UHFFFAOYSA-N
XLogP2.72
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1,1-dichloro-2-octylcyclopropane
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(2R)-1,1-difluoro-2-octylcyclopropane
CID 122227717
(1R,3R)-1,4-dimethyl-3-nitroso-3-pentylbicyclo[3.1.0]hexane
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(3R,5S)-3-butyl-2,2,5-trimethylpyrrolidine
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(2S,3R,5S)-5-butylspiro[2.2]pentane-2-carbaldehyde
CID 131231505
2'-pentylspiro[bicyclo[2.1.1]hexane-5,1'-cyclopropane]
CID 123756901
N-ethyl-1-methyl-2-pentylcyclopropan-1-amine
CID 123705841
5-butyl-3,3-dimethylcyclohexan-1-one
CID 12724545
(1-amino-2-butylcyclopropyl)phosphonic acid
CID 102050175

Frequently Asked Questions

What is the IUPAC name of 2-butyl-1-methyl-1-nitrosocyclopropane?
The IUPAC name of 2-butyl-1-methyl-1-nitrosocyclopropane (CID 88564371) is 2-butyl-1-methyl-1-nitrosocyclopropane.
What is the SMILES notation for 2-butyl-1-methyl-1-nitrosocyclopropane?
The canonical SMILES for 2-butyl-1-methyl-1-nitrosocyclopropane is CCCCC1CC1(C)N=O.
What is the InChIKey of 2-butyl-1-methyl-1-nitrosocyclopropane?
The InChIKey is BYXDXNWHIILCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-4-5-7-6-8(7,2)9-10/h7H,3-6H2,1-2H3.
What are the key properties of 2-butyl-1-methyl-1-nitrosocyclopropane?
2-butyl-1-methyl-1-nitrosocyclopropane has a molecular weight of 141.21 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1-methyl-1-nitrosocyclopropane is sourced from PubChem (CID 88564371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).