(1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide

C15H25NO2 — CID 158942828

IUPAC(1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide
SMILESCC(C)(C)C1CC(CNC(=O)[C@@H]2CCC(=O)C2)C1
InChIInChI=1S/C15H25NO2/c1-15(2,3)12-6-10(7-12)9-16-14(18)11-4-5-13(17)8-11/h10-12H,4-9H2,1-3H3,(H,16,18)/t10?,11-,12?/m1/s1
InChIKeyPLFBBXLPNOGWQN-MOENNCHZSA-N
MW251.37 g/mol
LogP2.54
Rot. Bonds3

About (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide

(1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide (PubChem CID 158942828) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide.

Molecular Properties

Compound Name(1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide
PubChem CID158942828
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name(1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide
SMILESCC(C)(C)C1CC(CNC(=O)[C@@H]2CCC(=O)C2)C1
InChIInChI=1S/C15H25NO2/c1-15(2,3)12-6-10(7-12)9-16-14(18)11-4-5-13(17)8-11/h10-12H,4-9H2,1-3H3,(H,16,18)/t10?,11-,12?/m1/s1
InChIKeyPLFBBXLPNOGWQN-MOENNCHZSA-N
XLogP2.54
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide?
The IUPAC name of (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide (CID 158942828) is (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide.
What is the SMILES notation for (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide?
The canonical SMILES for (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide is CC(C)(C)C1CC(CNC(=O)[C@@H]2CCC(=O)C2)C1.
What is the InChIKey of (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide?
The InChIKey is PLFBBXLPNOGWQN-MOENNCHZSA-N. The full InChI is InChI=1S/C15H25NO2/c1-15(2,3)12-6-10(7-12)9-16-14(18)11-4-5-13(17)8-11/h10-12H,4-9H2,1-3H3,(H,16,18)/t10?,11-,12?/m1/s1.
What are the key properties of (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide?
(1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide has a molecular weight of 251.37 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[(3-tert-butylcyclobutyl)methyl]-3-oxocyclopentane-1-carboxamide is sourced from PubChem (CID 158942828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).