1-amino-3-cyclopentylpropan-2-one

C8H15NO — CID 65179849

IUPAC1-amino-3-cyclopentylpropan-2-one
SMILESNCC(=O)CC1CCCC1
InChIInChI=1S/C8H15NO/c9-6-8(10)5-7-3-1-2-4-7/h7H,1-6,9H2
InChIKeyOOZDMPVHNNWODG-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.09
Rot. Bonds3

About 1-amino-3-cyclopentylpropan-2-one

1-amino-3-cyclopentylpropan-2-one (PubChem CID 65179849) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1-amino-3-cyclopentylpropan-2-one.

Molecular Properties

Compound Name1-amino-3-cyclopentylpropan-2-one
PubChem CID65179849
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1-amino-3-cyclopentylpropan-2-one
SMILESNCC(=O)CC1CCCC1
InChIInChI=1S/C8H15NO/c9-6-8(10)5-7-3-1-2-4-7/h7H,1-6,9H2
InChIKeyOOZDMPVHNNWODG-UHFFFAOYSA-N
XLogP1.09
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-cyclopentylpropan-2-one?
The IUPAC name of 1-amino-3-cyclopentylpropan-2-one (CID 65179849) is 1-amino-3-cyclopentylpropan-2-one.
What is the SMILES notation for 1-amino-3-cyclopentylpropan-2-one?
The canonical SMILES for 1-amino-3-cyclopentylpropan-2-one is NCC(=O)CC1CCCC1.
What is the InChIKey of 1-amino-3-cyclopentylpropan-2-one?
The InChIKey is OOZDMPVHNNWODG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c9-6-8(10)5-7-3-1-2-4-7/h7H,1-6,9H2.
What are the key properties of 1-amino-3-cyclopentylpropan-2-one?
1-amino-3-cyclopentylpropan-2-one has a molecular weight of 141.21 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-cyclopentylpropan-2-one is sourced from PubChem (CID 65179849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).