(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane

C11H23NO — CID 142810125

IUPAC(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane
SMILESCC/C=C(/CN)OCC.CC1CC1
InChIInChI=1S/C7H15NO.C4H8/c1-3-5-7(6-8)9-4-2;1-4-2-3-4/h5H,3-4,6,8H2,1-2H3;4H,2-3H2,1H3/b7-5-;
InChIKeyRZCWERDCVYRJMA-YJOCEBFMSA-N
MW185.31 g/mol
LogP2.69
Rot. Bonds4

About (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane

(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane (PubChem CID 142810125) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane.

Molecular Properties

Compound Name(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane
PubChem CID142810125
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane
SMILESCC/C=C(/CN)OCC.CC1CC1
InChIInChI=1S/C7H15NO.C4H8/c1-3-5-7(6-8)9-4-2;1-4-2-3-4/h5H,3-4,6,8H2,1-2H3;4H,2-3H2,1H3/b7-5-;
InChIKeyRZCWERDCVYRJMA-YJOCEBFMSA-N
XLogP2.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2-Methoxy-4-methylpent-2-en-1-amine
CID 54437080
2-methylpropane;(Z)-2-propan-2-yloxybut-2-en-1-amine
CID 142180418
(Z)-2-methoxy-4,5-dimethylhex-2-en-1-amine;2-methylpropane
CID 142180785
3,4-dihydro-2H-pyran-6-ylmethanamine;ethane
CID 142274774
ethane;fluoroethane;(Z)-2-methoxy-4-methylpent-2-en-1-amine
CID 142810077
(Z)-2-ethoxypent-2-en-1-amine
CID 142810126
ethane;2-methylpropane;(Z)-2-prop-1-en-2-yloxypent-2-en-1-amine
CID 142810190
ethane;(Z)-2-ethoxypent-2-en-1-amine;fluoroethane
CID 142883613
(2,3-Dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane
CID 142883616
(Z)-2-ethoxy-4-methylpent-2-en-1-amine;methylcyclopropane
CID 143080229
acetylene;(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane
CID 143080478
(3-Methyl-2,3-dihydrofuran-5-yl)methanamine
CID 143339092

Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane?
The IUPAC name of (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane (CID 142810125) is (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane.
What is the SMILES notation for (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane?
The canonical SMILES for (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane is CC/C=C(/CN)OCC.CC1CC1.
What is the InChIKey of (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane?
The InChIKey is RZCWERDCVYRJMA-YJOCEBFMSA-N. The full InChI is InChI=1S/C7H15NO.C4H8/c1-3-5-7(6-8)9-4-2;1-4-2-3-4/h5H,3-4,6,8H2,1-2H3;4H,2-3H2,1H3/b7-5-;.
What are the key properties of (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane?
(Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane has a molecular weight of 185.31 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethoxypent-2-en-1-amine;methylcyclopropane is sourced from PubChem (CID 142810125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).