cyclohexane;propanamide

C9H19NO — CID 143816223

IUPACcyclohexane;propanamide
SMILESC1CCCCC1.CCC(N)=O
InChIInChI=1S/C6H12.C3H7NO/c1-2-4-6-5-3-1;1-2-3(4)5/h1-6H2;2H2,1H3,(H2,4,5)
InChIKeyYIKBOLYXWYAKMX-UHFFFAOYSA-N
MW157.26 g/mol
LogP2.22
Rot. Bonds1

About cyclohexane;propanamide

cyclohexane;propanamide (PubChem CID 143816223) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is cyclohexane;propanamide.

Molecular Properties

Compound Namecyclohexane;propanamide
PubChem CID143816223
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Namecyclohexane;propanamide
SMILESC1CCCCC1.CCC(N)=O
InChIInChI=1S/C6H12.C3H7NO/c1-2-4-6-5-3-1;1-2-3(4)5/h1-6H2;2H2,1H3,(H2,4,5)
InChIKeyYIKBOLYXWYAKMX-UHFFFAOYSA-N
XLogP2.22
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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guanidine;propanamide
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propanamide;bis(propan-1-amine)
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cyclopropanecarboxamide;propanamide
CID 174752815
propanoic acid;urea
CID 22102181
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CID 143012181
propanamide;thionyl dichloride
CID 161371403
propanamide;propanedioic acid
CID 174420039

Frequently Asked Questions

What is the IUPAC name of cyclohexane;propanamide?
The IUPAC name of cyclohexane;propanamide (CID 143816223) is cyclohexane;propanamide.
What is the SMILES notation for cyclohexane;propanamide?
The canonical SMILES for cyclohexane;propanamide is C1CCCCC1.CCC(N)=O.
What is the InChIKey of cyclohexane;propanamide?
The InChIKey is YIKBOLYXWYAKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.C3H7NO/c1-2-4-6-5-3-1;1-2-3(4)5/h1-6H2;2H2,1H3,(H2,4,5).
What are the key properties of cyclohexane;propanamide?
cyclohexane;propanamide has a molecular weight of 157.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;propanamide is sourced from PubChem (CID 143816223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).