ethane;N-[4-(propanoylamino)cyclohexyl]propanamide

C16H34N2O2 — CID 144871719

IUPACethane;N-[4-(propanoylamino)cyclohexyl]propanamide
SMILESCC.CC.CCC(=O)NC1CCC(NC(=O)CC)CC1
InChIInChI=1S/C12H22N2O2.2C2H6/c1-3-11(15)13-9-5-7-10(8-6-9)14-12(16)4-2;2*1-2/h9-10H,3-8H2,1-2H3,(H,13,15)(H,14,16);2*1-2H3
InChIKeyBLXBUKBOEVEUJN-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.40
Rot. Bonds4

About ethane;N-[4-(propanoylamino)cyclohexyl]propanamide

ethane;N-[4-(propanoylamino)cyclohexyl]propanamide (PubChem CID 144871719) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is ethane;N-[4-(propanoylamino)cyclohexyl]propanamide.

Molecular Properties

Compound Nameethane;N-[4-(propanoylamino)cyclohexyl]propanamide
PubChem CID144871719
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC Nameethane;N-[4-(propanoylamino)cyclohexyl]propanamide
SMILESCC.CC.CCC(=O)NC1CCC(NC(=O)CC)CC1
InChIInChI=1S/C12H22N2O2.2C2H6/c1-3-11(15)13-9-5-7-10(8-6-9)14-12(16)4-2;2*1-2/h9-10H,3-8H2,1-2H3,(H,13,15)(H,14,16);2*1-2H3
InChIKeyBLXBUKBOEVEUJN-UHFFFAOYSA-N
XLogP3.40
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-cyclododecylpropanamide
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potassium;N-cyclohexylpropanamide;hydride
CID 173020790
[4-[[4-(propanoylamino)cyclohexyl]methyl]cyclohexyl]carbamic acid
CID 70827651
N-(3-aminocyclopentyl)propanamide
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CID 170769048
N-pyrrolidin-3-ylpropanamide
CID 18337238
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CID 5225156
N-[1-(2-methylpropyl)piperidin-4-yl]propanamide
CID 71193586
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Frequently Asked Questions

What is the IUPAC name of ethane;N-[4-(propanoylamino)cyclohexyl]propanamide?
The IUPAC name of ethane;N-[4-(propanoylamino)cyclohexyl]propanamide (CID 144871719) is ethane;N-[4-(propanoylamino)cyclohexyl]propanamide.
What is the SMILES notation for ethane;N-[4-(propanoylamino)cyclohexyl]propanamide?
The canonical SMILES for ethane;N-[4-(propanoylamino)cyclohexyl]propanamide is CC.CC.CCC(=O)NC1CCC(NC(=O)CC)CC1.
What is the InChIKey of ethane;N-[4-(propanoylamino)cyclohexyl]propanamide?
The InChIKey is BLXBUKBOEVEUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.2C2H6/c1-3-11(15)13-9-5-7-10(8-6-9)14-12(16)4-2;2*1-2/h9-10H,3-8H2,1-2H3,(H,13,15)(H,14,16);2*1-2H3.
What are the key properties of ethane;N-[4-(propanoylamino)cyclohexyl]propanamide?
ethane;N-[4-(propanoylamino)cyclohexyl]propanamide has a molecular weight of 286.46 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[4-(propanoylamino)cyclohexyl]propanamide is sourced from PubChem (CID 144871719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).