5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one

C14H22N4O — CID 64798975

IUPAC5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one
SMILESO=C1CCC(NCc2ccn(C3CCCC3)n2)CN1
InChIInChI=1S/C14H22N4O/c19-14-6-5-11(9-16-14)15-10-12-7-8-18(17-12)13-3-1-2-4-13/h7-8,11,13,15H,1-6,9-10H2,(H,16,19)
InChIKeyMQEDVRVPJXEDLF-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.37
Rot. Bonds4

About 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one

5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one (PubChem CID 64798975) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one.

Molecular Properties

Compound Name5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one
PubChem CID64798975
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one
SMILESO=C1CCC(NCc2ccn(C3CCCC3)n2)CN1
InChIInChI=1S/C14H22N4O/c19-14-6-5-11(9-16-14)15-10-12-7-8-18(17-12)13-3-1-2-4-13/h7-8,11,13,15H,1-6,9-10H2,(H,16,19)
InChIKeyMQEDVRVPJXEDLF-UHFFFAOYSA-N
XLogP1.37
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[(1-cyclohexylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 65023954
3-[(1-cyclopentylpyrazol-3-yl)methyl]-1,3-diazinane-2,4-dione
CID 146143412
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1,1-dioxothian-3-amine
CID 64799368
N-[(1-cyclopentylpyrazol-3-yl)methyl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79358924
N-[(1-cyclohexylpyrazol-3-yl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 114546024
5-(pyridin-4-ylmethylamino)piperidin-2-one
CID 63378640
2-chloro-N-[(1-cyclopentylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 65025723
N-[(1-cyclohexylpyrazol-3-yl)methyl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79359218
4-[(1-propan-2-ylpyrazol-3-yl)methylamino]pyrrolidin-2-one
CID 106189037
5-[(6-bromo-2-pyridinyl)methylamino]piperidin-2-one
CID 112582371
5-(1,2,5-thiadiazol-3-ylmethylamino)piperidin-2-one
CID 130986202
N-[(1-cyclohexylpyrazol-3-yl)methyl]-2-methylcyclohexan-1-amine
CID 64800246

Frequently Asked Questions

What is the IUPAC name of 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one?
The IUPAC name of 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one (CID 64798975) is 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one.
What is the SMILES notation for 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one?
The canonical SMILES for 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one is O=C1CCC(NCc2ccn(C3CCCC3)n2)CN1.
What is the InChIKey of 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one?
The InChIKey is MQEDVRVPJXEDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c19-14-6-5-11(9-16-14)15-10-12-7-8-18(17-12)13-3-1-2-4-13/h7-8,11,13,15H,1-6,9-10H2,(H,16,19).
What are the key properties of 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one?
5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one has a molecular weight of 262.36 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-cyclopentylpyrazol-3-yl)methylamino]piperidin-2-one is sourced from PubChem (CID 64798975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).