N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide

C14H25NO3 — CID 170603649

IUPACN-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide
SMILESCCC1COC(NC(=O)C2(C(C)C)CCC2)C1O
InChIInChI=1S/C14H25NO3/c1-4-10-8-18-12(11(10)16)15-13(17)14(9(2)3)6-5-7-14/h9-12,16H,4-8H2,1-3H3,(H,15,17)
InChIKeyWIZUDBXATORGNP-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.67
Rot. Bonds4

About N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide

N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide (PubChem CID 170603649) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide
PubChem CID170603649
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC NameN-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide
SMILESCCC1COC(NC(=O)C2(C(C)C)CCC2)C1O
InChIInChI=1S/C14H25NO3/c1-4-10-8-18-12(11(10)16)15-13(17)14(9(2)3)6-5-7-14/h9-12,16H,4-8H2,1-3H3,(H,15,17)
InChIKeyWIZUDBXATORGNP-UHFFFAOYSA-N
XLogP1.67
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide?
The IUPAC name of N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide (CID 170603649) is N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide.
What is the SMILES notation for N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide?
The canonical SMILES for N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide is CCC1COC(NC(=O)C2(C(C)C)CCC2)C1O.
What is the InChIKey of N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide?
The InChIKey is WIZUDBXATORGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-4-10-8-18-12(11(10)16)15-13(17)14(9(2)3)6-5-7-14/h9-12,16H,4-8H2,1-3H3,(H,15,17).
What are the key properties of N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide?
N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-3-hydroxyoxolan-2-yl)-1-propan-2-ylcyclobutane-1-carboxamide is sourced from PubChem (CID 170603649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).