N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide

C16H25NO2 — CID 2974492

IUPACN-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
SMILESCC12CCC(C(=O)NC3CCCC3)(CC1=O)C2(C)C
InChIInChI=1S/C16H25NO2/c1-14(2)15(3)8-9-16(14,10-12(15)18)13(19)17-11-6-4-5-7-11/h11H,4-10H2,1-3H3,(H,17,19)
InChIKeyUCEYPXUDZFDONN-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.83
Rot. Bonds2

About N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide

N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide (PubChem CID 2974492) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
PubChem CID2974492
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
SMILESCC12CCC(C(=O)NC3CCCC3)(CC1=O)C2(C)C
InChIInChI=1S/C16H25NO2/c1-14(2)15(3)8-9-16(14,10-12(15)18)13(19)17-11-6-4-5-7-11/h11H,4-10H2,1-3H3,(H,17,19)
InChIKeyUCEYPXUDZFDONN-UHFFFAOYSA-N
XLogP2.83
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
The IUPAC name of N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide (CID 2974492) is N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide is CC12CCC(C(=O)NC3CCCC3)(CC1=O)C2(C)C.
What is the InChIKey of N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
The InChIKey is UCEYPXUDZFDONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-14(2)15(3)8-9-16(14,10-12(15)18)13(19)17-11-6-4-5-7-11/h11H,4-10H2,1-3H3,(H,17,19).
What are the key properties of N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide?
N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide is sourced from PubChem (CID 2974492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).