3-cyclohexylpropanamide;ethane;methanamine

C12H28N2O — CID 178116013

IUPAC3-cyclohexylpropanamide;ethane;methanamine
SMILESCC.CN.NC(=O)CCC1CCCCC1
InChIInChI=1S/C9H17NO.C2H6.CH5N/c10-9(11)7-6-8-4-2-1-3-5-8;2*1-2/h8H,1-7H2,(H2,10,11);1-2H3;2H2,1H3
InChIKeyPZPCNTHFFZHETK-UHFFFAOYSA-N
MW216.37 g/mol
LogP2.43
Rot. Bonds3

About 3-cyclohexylpropanamide;ethane;methanamine

3-cyclohexylpropanamide;ethane;methanamine (PubChem CID 178116013) has the molecular formula C12H28N2O and a molecular weight of 216.37 g/mol. Its IUPAC name is 3-cyclohexylpropanamide;ethane;methanamine.

Molecular Properties

Compound Name3-cyclohexylpropanamide;ethane;methanamine
PubChem CID178116013
Molecular FormulaC12H28N2O
Molecular Weight216.37 g/mol
Exact Mass216.22
IUPAC Name3-cyclohexylpropanamide;ethane;methanamine
SMILESCC.CN.NC(=O)CCC1CCCCC1
InChIInChI=1S/C9H17NO.C2H6.CH5N/c10-9(11)7-6-8-4-2-1-3-5-8;2*1-2/h8H,1-7H2,(H2,10,11);1-2H3;2H2,1H3
InChIKeyPZPCNTHFFZHETK-UHFFFAOYSA-N
XLogP2.43
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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3-cyclohexylpropanoic acid;ethane;propane
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3-cycloheptyl-1-cyclopropylpropan-1-one
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1-cyclohexylhexan-3-one
CID 10856142
N-(2-amino-2-oxoethyl)-3-cyclopentylpropanamide
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2-cyclodecylacetamide
CID 150110792
cyclohexanamine;hexanediamide;methane
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2-cyclohexylacetic acid;ethane;methanamine
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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexylpropanamide;ethane;methanamine?
The IUPAC name of 3-cyclohexylpropanamide;ethane;methanamine (CID 178116013) is 3-cyclohexylpropanamide;ethane;methanamine.
What is the SMILES notation for 3-cyclohexylpropanamide;ethane;methanamine?
The canonical SMILES for 3-cyclohexylpropanamide;ethane;methanamine is CC.CN.NC(=O)CCC1CCCCC1.
What is the InChIKey of 3-cyclohexylpropanamide;ethane;methanamine?
The InChIKey is PZPCNTHFFZHETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.C2H6.CH5N/c10-9(11)7-6-8-4-2-1-3-5-8;2*1-2/h8H,1-7H2,(H2,10,11);1-2H3;2H2,1H3.
What are the key properties of 3-cyclohexylpropanamide;ethane;methanamine?
3-cyclohexylpropanamide;ethane;methanamine has a molecular weight of 216.37 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexylpropanamide;ethane;methanamine is sourced from PubChem (CID 178116013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).