(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone

C14H22N4O — CID 146680609

IUPAC(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone
SMILESNc1nn(C2CCCC2)cc1C(=O)N1CCCCC1
InChIInChI=1S/C14H22N4O/c15-13-12(14(19)17-8-4-1-5-9-17)10-18(16-13)11-6-2-3-7-11/h10-11H,1-9H2,(H2,15,16)
InChIKeyDXWIUIQITGISFL-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.21
Rot. Bonds2

About (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone

(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone (PubChem CID 146680609) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone
PubChem CID146680609
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone
SMILESNc1nn(C2CCCC2)cc1C(=O)N1CCCCC1
InChIInChI=1S/C14H22N4O/c15-13-12(14(19)17-8-4-1-5-9-17)10-18(16-13)11-6-2-3-7-11/h10-11H,1-9H2,(H2,15,16)
InChIKeyDXWIUIQITGISFL-UHFFFAOYSA-N
XLogP2.21
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone?
The IUPAC name of (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone (CID 146680609) is (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone is Nc1nn(C2CCCC2)cc1C(=O)N1CCCCC1.
What is the InChIKey of (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone?
The InChIKey is DXWIUIQITGISFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c15-13-12(14(19)17-8-4-1-5-9-17)10-18(16-13)11-6-2-3-7-11/h10-11H,1-9H2,(H2,15,16).
What are the key properties of (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone?
(3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone has a molecular weight of 262.36 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-1-cyclopentylpyrazol-4-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 146680609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).