N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide

C15H26N2O2 — CID 800535

IUPACN-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide
SMILESO=C(CNC(=O)C1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H26N2O2/c18-14(17-13-9-5-2-6-10-13)11-16-15(19)12-7-3-1-4-8-12/h12-13H,1-11H2,(H,16,19)(H,17,18)
InChIKeyPHPDRDGUPXRXHI-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.13
Rot. Bonds4

About N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide

N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide (PubChem CID 800535) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide
PubChem CID800535
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide
SMILESO=C(CNC(=O)C1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H26N2O2/c18-14(17-13-9-5-2-6-10-13)11-16-15(19)12-7-3-1-4-8-12/h12-13H,1-11H2,(H,16,19)(H,17,18)
InChIKeyPHPDRDGUPXRXHI-UHFFFAOYSA-N
XLogP2.13
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide (CID 800535) is N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide is O=C(CNC(=O)C1CCCCC1)NC1CCCCC1.
What is the InChIKey of N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide?
The InChIKey is PHPDRDGUPXRXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c18-14(17-13-9-5-2-6-10-13)11-16-15(19)12-7-3-1-4-8-12/h12-13H,1-11H2,(H,16,19)(H,17,18).
What are the key properties of N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide?
N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide has a molecular weight of 266.38 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexylamino)-2-oxoethyl]cyclohexanecarboxamide is sourced from PubChem (CID 800535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).