N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide

C11H19NO — CID 155930178

IUPACN-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide
SMILESC/C=C/N(C)C(=O)C1CCCCC1
InChIInChI=1S/C11H19NO/c1-3-9-12(2)11(13)10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3/b9-3+
InChIKeyVFUMHIZOKJHVSU-YCRREMRBSA-N
MW181.28 g/mol
LogP2.56
Rot. Bonds2

About N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide

N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide (PubChem CID 155930178) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide
PubChem CID155930178
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC NameN-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide
SMILESC/C=C/N(C)C(=O)C1CCCCC1
InChIInChI=1S/C11H19NO/c1-3-9-12(2)11(13)10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3/b9-3+
InChIKeyVFUMHIZOKJHVSU-YCRREMRBSA-N
XLogP2.56
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
The IUPAC name of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide (CID 155930178) is N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide.
What is the SMILES notation for N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
The canonical SMILES for N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide is C/C=C/N(C)C(=O)C1CCCCC1.
What is the InChIKey of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
The InChIKey is VFUMHIZOKJHVSU-YCRREMRBSA-N. The full InChI is InChI=1S/C11H19NO/c1-3-9-12(2)11(13)10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3/b9-3+.
What are the key properties of N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide?
N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide has a molecular weight of 181.28 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(E)-prop-1-enyl]cyclohexanecarboxamide is sourced from PubChem (CID 155930178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).