N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide

C14H27NO2 — CID 126590806

IUPACN-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide
SMILESCC(C)NC(=O)CC1CCCCC1OC(C)C
InChIInChI=1S/C14H27NO2/c1-10(2)15-14(16)9-12-7-5-6-8-13(12)17-11(3)4/h10-13H,5-9H2,1-4H3,(H,15,16)
InChIKeyDTLSMIPWFCVILL-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.88
Rot. Bonds5

About N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide

N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide (PubChem CID 126590806) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide
PubChem CID126590806
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide
SMILESCC(C)NC(=O)CC1CCCCC1OC(C)C
InChIInChI=1S/C14H27NO2/c1-10(2)15-14(16)9-12-7-5-6-8-13(12)17-11(3)4/h10-13H,5-9H2,1-4H3,(H,15,16)
InChIKeyDTLSMIPWFCVILL-UHFFFAOYSA-N
XLogP2.88
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide?
The IUPAC name of N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide (CID 126590806) is N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide.
What is the SMILES notation for N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide?
The canonical SMILES for N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide is CC(C)NC(=O)CC1CCCCC1OC(C)C.
What is the InChIKey of N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide?
The InChIKey is DTLSMIPWFCVILL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-10(2)15-14(16)9-12-7-5-6-8-13(12)17-11(3)4/h10-13H,5-9H2,1-4H3,(H,15,16).
What are the key properties of N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide?
N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide has a molecular weight of 241.37 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(2-propan-2-yloxycyclohexyl)acetamide is sourced from PubChem (CID 126590806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).