N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide

C14H21N5O — CID 11492806

IUPACN'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide
SMILESCC(C)CN(NC(=O)C(C)(C)C)c1ccnc(C#N)n1
InChIInChI=1S/C14H21N5O/c1-10(2)9-19(18-13(20)14(3,4)5)12-6-7-16-11(8-15)17-12/h6-7,10H,9H2,1-5H3,(H,18,20)
InChIKeyHPPWAAGQSSRKGO-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.89
Rot. Bonds4

About N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide

N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide (PubChem CID 11492806) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide.

Molecular Properties

Compound NameN'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide
PubChem CID11492806
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide
SMILESCC(C)CN(NC(=O)C(C)(C)C)c1ccnc(C#N)n1
InChIInChI=1S/C14H21N5O/c1-10(2)9-19(18-13(20)14(3,4)5)12-6-7-16-11(8-15)17-12/h6-7,10H,9H2,1-5H3,(H,18,20)
InChIKeyHPPWAAGQSSRKGO-UHFFFAOYSA-N
XLogP1.89
TPSA81.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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 N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide?
The IUPAC name of N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide (CID 11492806) is N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide.
What is the SMILES notation for N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide?
The canonical SMILES for N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide is CC(C)CN(NC(=O)C(C)(C)C)c1ccnc(C#N)n1.
What is the InChIKey of N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide?
The InChIKey is HPPWAAGQSSRKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-10(2)9-19(18-13(20)14(3,4)5)12-6-7-16-11(8-15)17-12/h6-7,10H,9H2,1-5H3,(H,18,20).
What are the key properties of N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide?
N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide has a molecular weight of 275.36 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-cyanopyrimidin-4-yl)-2,2-dimethyl-N'-(2-methylpropyl)propanehydrazide is sourced from PubChem (CID 11492806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).