(E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide

C10H17NO2 — CID 155905067

IUPAC(E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide
SMILESCN(C)C(=O)/C=C/C1CCC(O)C1
InChIInChI=1S/C10H17NO2/c1-11(2)10(13)6-4-8-3-5-9(12)7-8/h4,6,8-9,12H,3,5,7H2,1-2H3/b6-4+
InChIKeyYFIWMUPNIMPKGN-GQCTYLIASA-N
MW183.25 g/mol
LogP0.79
Rot. Bonds2

About (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide

(E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide (PubChem CID 155905067) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide
PubChem CID155905067
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide
SMILESCN(C)C(=O)/C=C/C1CCC(O)C1
InChIInChI=1S/C10H17NO2/c1-11(2)10(13)6-4-8-3-5-9(12)7-8/h4,6,8-9,12H,3,5,7H2,1-2H3/b6-4+
InChIKeyYFIWMUPNIMPKGN-GQCTYLIASA-N
XLogP0.79
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide?
The IUPAC name of (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide (CID 155905067) is (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide.
What is the SMILES notation for (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide?
The canonical SMILES for (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide is CN(C)C(=O)/C=C/C1CCC(O)C1.
What is the InChIKey of (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide?
The InChIKey is YFIWMUPNIMPKGN-GQCTYLIASA-N. The full InChI is InChI=1S/C10H17NO2/c1-11(2)10(13)6-4-8-3-5-9(12)7-8/h4,6,8-9,12H,3,5,7H2,1-2H3/b6-4+.
What are the key properties of (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide?
(E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide has a molecular weight of 183.25 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(3-hydroxycyclopentyl)-N,N-dimethylprop-2-enamide is sourced from PubChem (CID 155905067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).