(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone

C10H15N3O — CID 19577577

IUPAC(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone
SMILESCn1ccc(C(=O)N2CCCCC2)n1
InChIInChI=1S/C10H15N3O/c1-12-8-5-9(11-12)10(14)13-6-3-2-4-7-13/h5,8H,2-4,6-7H2,1H3
InChIKeyVRQONWOQRRQFFU-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.05
Rot. Bonds1

About (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone

(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone (PubChem CID 19577577) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone
PubChem CID19577577
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone
SMILESCn1ccc(C(=O)N2CCCCC2)n1
InChIInChI=1S/C10H15N3O/c1-12-8-5-9(11-12)10(14)13-6-3-2-4-7-13/h5,8H,2-4,6-7H2,1H3
InChIKeyVRQONWOQRRQFFU-UHFFFAOYSA-N
XLogP1.05
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methylpiperazin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 2172453
(3S)-N,N-dimethyl-1-(1-methylpyrazole-3-carbonyl)piperidine-3-carboxamide
CID 95828671
1-(1-methylpyrazole-3-carbonyl)piperidin-3-one
CID 103118157
(3-methylazetidin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 123809651
(1-methylpyrazol-3-yl)-(4-prop-2-enyl-1,4-diazepan-1-yl)methanone
CID 95749808
(1-methylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 4770499
[4-(aminomethyl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 103115889
1-methyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxamide
CID 169248379
1,4-dioxa-9-azaspiro[4.5]decan-9-yl-(1-methylpyrazol-3-yl)methanone
CID 103860781
[3-(chloromethyl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 103122381
[3-(bromomethyl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 103122473
[4-(5-methoxypyrimidin-2-yl)-1,4-diazepan-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 172900503

Frequently Asked Questions

What is the IUPAC name of (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone?
The IUPAC name of (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone (CID 19577577) is (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone is Cn1ccc(C(=O)N2CCCCC2)n1.
What is the InChIKey of (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone?
The InChIKey is VRQONWOQRRQFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-12-8-5-9(11-12)10(14)13-6-3-2-4-7-13/h5,8H,2-4,6-7H2,1H3.
What are the key properties of (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone?
(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone has a molecular weight of 193.25 g/mol, XLogP of 1.05, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrazol-3-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 19577577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).