1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide

C15H26N2O2 — CID 103722771

IUPAC1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide
SMILESCCCC(CCO)CNC(=O)C1(C#N)CCCCC1
InChIInChI=1S/C15H26N2O2/c1-2-6-13(7-10-18)11-17-14(19)15(12-16)8-4-3-5-9-15/h13,18H,2-11H2,1H3,(H,17,19)
InChIKeyNWQXUSLMYGNPTB-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.38
Rot. Bonds7

About 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide

1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide (PubChem CID 103722771) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide
PubChem CID103722771
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide
SMILESCCCC(CCO)CNC(=O)C1(C#N)CCCCC1
InChIInChI=1S/C15H26N2O2/c1-2-6-13(7-10-18)11-17-14(19)15(12-16)8-4-3-5-9-15/h13,18H,2-11H2,1H3,(H,17,19)
InChIKeyNWQXUSLMYGNPTB-UHFFFAOYSA-N
XLogP2.38
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyano-N-[2-(2-hydroxyethyl)pentyl]oxane-4-carboxamide
CID 103725573
1-amino-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide
CID 106116803
1-cyano-N-hexan-3-ylcyclohexane-1-carboxamide
CID 62045712
1-(aminomethyl)-N-[2-(2-hydroxyethyl)pentyl]cyclobutane-1-carboxamide
CID 106116673
1-cyano-N-pentan-2-ylcyclopentane-1-carboxamide
CID 55025382
N-[2-(2-hydroxyethyl)pentyl]-2-(methylamino)acetamide;hydrochloride
CID 120704813
1-[2-(2-hydroxyethyl)pentyl]-3-[(1-methylcyclopentyl)methyl]urea
CID 111506160
3-ethyl-N-[2-(2-hydroxyethyl)pentyl]pyrrolidine-3-carboxamide
CID 106116627
1-cyano-N-[2-(ethylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 61461650
1-cyano-N-(5-hydroxy-4-methylpentyl)cycloheptane-1-carboxamide
CID 106161672
1-cyano-N-(4-methylpentyl)cyclopentane-1-carboxamide
CID 60738598
2-cyano-N-[2-(2-hydroxyethyl)pentyl]pentanamide
CID 106116827

Frequently Asked Questions

What is the IUPAC name of 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide?
The IUPAC name of 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide (CID 103722771) is 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide?
The canonical SMILES for 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide is CCCC(CCO)CNC(=O)C1(C#N)CCCCC1.
What is the InChIKey of 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide?
The InChIKey is NWQXUSLMYGNPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-2-6-13(7-10-18)11-17-14(19)15(12-16)8-4-3-5-9-15/h13,18H,2-11H2,1H3,(H,17,19).
What are the key properties of 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide?
1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide has a molecular weight of 266.38 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N-[2-(2-hydroxyethyl)pentyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 103722771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).