N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide

C14H26N2O3 — CID 3134404

IUPACN'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide
SMILESCC(C)OCCCNC(=O)C(=O)NC1CCCCC1
InChIInChI=1S/C14H26N2O3/c1-11(2)19-10-6-9-15-13(17)14(18)16-12-7-4-3-5-8-12/h11-12H,3-10H2,1-2H3,(H,15,17)(H,16,18)
InChIKeySDRRVMRQNJUVMZ-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.37
Rot. Bonds6

About N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide

N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide (PubChem CID 3134404) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide.

Molecular Properties

Compound NameN'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide
PubChem CID3134404
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide
SMILESCC(C)OCCCNC(=O)C(=O)NC1CCCCC1
InChIInChI=1S/C14H26N2O3/c1-11(2)19-10-6-9-15-13(17)14(18)16-12-7-4-3-5-8-12/h11-12H,3-10H2,1-2H3,(H,15,17)(H,16,18)
InChIKeySDRRVMRQNJUVMZ-UHFFFAOYSA-N
XLogP1.37
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide?
The IUPAC name of N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide (CID 3134404) is N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide.
What is the SMILES notation for N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide?
The canonical SMILES for N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide is CC(C)OCCCNC(=O)C(=O)NC1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide?
The InChIKey is SDRRVMRQNJUVMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-11(2)19-10-6-9-15-13(17)14(18)16-12-7-4-3-5-8-12/h11-12H,3-10H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide?
N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide has a molecular weight of 270.37 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N-(3-propan-2-yloxypropyl)oxamide is sourced from PubChem (CID 3134404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).