N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide

C7H12N2O2 — CID 88564364

IUPACN,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide
SMILESCN(C)C(=O)C1CC1(C)N=O
InChIInChI=1S/C7H12N2O2/c1-7(8-11)4-5(7)6(10)9(2)3/h5H,4H2,1-3H3
InChIKeyZFURKYRVDCDXCW-UHFFFAOYSA-N
MW156.18 g/mol
LogP0.62
Rot. Bonds2

About N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide

N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide (PubChem CID 88564364) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide
PubChem CID88564364
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC NameN,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide
SMILESCN(C)C(=O)C1CC1(C)N=O
InChIInChI=1S/C7H12N2O2/c1-7(8-11)4-5(7)6(10)9(2)3/h5H,4H2,1-3H3
InChIKeyZFURKYRVDCDXCW-UHFFFAOYSA-N
XLogP0.62
TPSA49.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide?
The IUPAC name of N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide (CID 88564364) is N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide.
What is the SMILES notation for N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide?
The canonical SMILES for N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide is CN(C)C(=O)C1CC1(C)N=O.
What is the InChIKey of N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide?
The InChIKey is ZFURKYRVDCDXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-7(8-11)4-5(7)6(10)9(2)3/h5H,4H2,1-3H3.
What are the key properties of N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide?
N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide has a molecular weight of 156.18 g/mol, XLogP of 0.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-2-nitrosocyclopropane-1-carboxamide is sourced from PubChem (CID 88564364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).