3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide

C14H22N4O — CID 30547326

IUPAC3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide
SMILESCc1cc(C)nc(NNC(=O)CCC2CCCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-9-11(2)16-14(15-10)18-17-13(19)8-7-12-5-3-4-6-12/h9,12H,3-8H2,1-2H3,(H,17,19)(H,15,16,18)
InChIKeyJFLJQJWYESYRRD-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.51
Rot. Bonds5

About 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide

3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide (PubChem CID 30547326) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide.

Molecular Properties

Compound Name3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide
PubChem CID30547326
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide
SMILESCc1cc(C)nc(NNC(=O)CCC2CCCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-9-11(2)16-14(15-10)18-17-13(19)8-7-12-5-3-4-6-12/h9,12H,3-8H2,1-2H3,(H,17,19)(H,15,16,18)
InChIKeyJFLJQJWYESYRRD-UHFFFAOYSA-N
XLogP2.51
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide?
The IUPAC name of 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide (CID 30547326) is 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide.
What is the SMILES notation for 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide?
The canonical SMILES for 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide is Cc1cc(C)nc(NNC(=O)CCC2CCCC2)n1.
What is the InChIKey of 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide?
The InChIKey is JFLJQJWYESYRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-9-11(2)16-14(15-10)18-17-13(19)8-7-12-5-3-4-6-12/h9,12H,3-8H2,1-2H3,(H,17,19)(H,15,16,18).
What are the key properties of 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide?
3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide has a molecular weight of 262.36 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N'-(4,6-dimethylpyrimidin-2-yl)propanehydrazide is sourced from PubChem (CID 30547326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).