(2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane

C11H17NO — CID 163714866

IUPAC(2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane
SMILESC=C1CCC(CCN=O)/C1=C/CC
InChIInChI=1S/C11H17NO/c1-3-4-11-9(2)5-6-10(11)7-8-12-13/h4,10H,2-3,5-8H2,1H3/b11-4+
InChIKeyKMLMSUYZKZWZGU-NYYWCZLTSA-N
MW179.26 g/mol
LogP3.45
Rot. Bonds4

About (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane

(2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane (PubChem CID 163714866) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane.

Molecular Properties

Compound Name(2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane
PubChem CID163714866
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name(2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane
SMILESC=C1CCC(CCN=O)/C1=C/CC
InChIInChI=1S/C11H17NO/c1-3-4-11-9(2)5-6-10(11)7-8-12-13/h4,10H,2-3,5-8H2,1H3/b11-4+
InChIKeyKMLMSUYZKZWZGU-NYYWCZLTSA-N
XLogP3.45
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane?
The IUPAC name of (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane (CID 163714866) is (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane.
What is the SMILES notation for (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane?
The canonical SMILES for (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane is C=C1CCC(CCN=O)/C1=C/CC.
What is the InChIKey of (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane?
The InChIKey is KMLMSUYZKZWZGU-NYYWCZLTSA-N. The full InChI is InChI=1S/C11H17NO/c1-3-4-11-9(2)5-6-10(11)7-8-12-13/h4,10H,2-3,5-8H2,1H3/b11-4+.
What are the key properties of (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane?
(2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane has a molecular weight of 179.26 g/mol, XLogP of 3.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-1-methylidene-3-(2-nitrosoethyl)-2-propylidenecyclopentane is sourced from PubChem (CID 163714866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).