4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide

C15H25N3O — CID 10264751

IUPAC4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide
SMILESO=C(CCCC1CCCCC1)NCCc1cnc[nH]1
InChIInChI=1S/C15H25N3O/c19-15(17-10-9-14-11-16-12-18-14)8-4-7-13-5-2-1-3-6-13/h11-13H,1-10H2,(H,16,18)(H,17,19)
InChIKeyDFRDUQVWPTVRRI-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.82
Rot. Bonds7

About 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide

4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide (PubChem CID 10264751) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide.

Molecular Properties

Compound Name4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide
PubChem CID10264751
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide
SMILESO=C(CCCC1CCCCC1)NCCc1cnc[nH]1
InChIInChI=1S/C15H25N3O/c19-15(17-10-9-14-11-16-12-18-14)8-4-7-13-5-2-1-3-6-13/h11-13H,1-10H2,(H,16,18)(H,17,19)
InChIKeyDFRDUQVWPTVRRI-UHFFFAOYSA-N
XLogP2.82
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide?
The IUPAC name of 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide (CID 10264751) is 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide.
What is the SMILES notation for 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide?
The canonical SMILES for 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide is O=C(CCCC1CCCCC1)NCCc1cnc[nH]1.
What is the InChIKey of 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide?
The InChIKey is DFRDUQVWPTVRRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c19-15(17-10-9-14-11-16-12-18-14)8-4-7-13-5-2-1-3-6-13/h11-13H,1-10H2,(H,16,18)(H,17,19).
What are the key properties of 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide?
4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide has a molecular weight of 263.38 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]butanamide is sourced from PubChem (CID 10264751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).