1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide

C13H24N2O — CID 80587539

IUPAC1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide
SMILESCC1CC(CN)(C(=O)N(C)C2CCCC2)C1
InChIInChI=1S/C13H24N2O/c1-10-7-13(8-10,9-14)12(16)15(2)11-5-3-4-6-11/h10-11H,3-9,14H2,1-2H3
InChIKeyFEQFYKWIJLZSGL-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.76
Rot. Bonds3

About 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide

1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide (PubChem CID 80587539) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide
PubChem CID80587539
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide
SMILESCC1CC(CN)(C(=O)N(C)C2CCCC2)C1
InChIInChI=1S/C13H24N2O/c1-10-7-13(8-10,9-14)12(16)15(2)11-5-3-4-6-11/h10-11H,3-9,14H2,1-2H3
InChIKeyFEQFYKWIJLZSGL-UHFFFAOYSA-N
XLogP1.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide (CID 80587539) is 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide is CC1CC(CN)(C(=O)N(C)C2CCCC2)C1.
What is the InChIKey of 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide?
The InChIKey is FEQFYKWIJLZSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-10-7-13(8-10,9-14)12(16)15(2)11-5-3-4-6-11/h10-11H,3-9,14H2,1-2H3.
What are the key properties of 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide?
1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-cyclopentyl-N,3-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 80587539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).