1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide

C13H24N2O — CID 80588635

IUPAC1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide
SMILESCCN(C(=O)C1(CN)CCC1)C1CCCC1
InChIInChI=1S/C13H24N2O/c1-2-15(11-6-3-4-7-11)12(16)13(10-14)8-5-9-13/h11H,2-10,14H2,1H3
InChIKeyZKZWGXMJKCBDLV-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.91
Rot. Bonds4

About 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide

1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide (PubChem CID 80588635) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide
PubChem CID80588635
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide
SMILESCCN(C(=O)C1(CN)CCC1)C1CCCC1
InChIInChI=1S/C13H24N2O/c1-2-15(11-6-3-4-7-11)12(16)13(10-14)8-5-9-13/h11H,2-10,14H2,1H3
InChIKeyZKZWGXMJKCBDLV-UHFFFAOYSA-N
XLogP1.91
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.91
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-ethylcyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide (CID 80588635) is 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide is CCN(C(=O)C1(CN)CCC1)C1CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide?
The InChIKey is ZKZWGXMJKCBDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-15(11-6-3-4-7-11)12(16)13(10-14)8-5-9-13/h11H,2-10,14H2,1H3.
What are the key properties of 1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide?
1-(aminomethyl)-N-cyclopentyl-N-ethylcyclobutane-1-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.91, 4 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-ethylcyclobutane-1-carboxamide is sourced from PubChem (CID 80588635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).