N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide

C14H25N5O — CID 62243662

IUPACN-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide
SMILESCC(C)c1ncc(NN)c(C(=O)N(C)CC(C)(C)C)n1
InChIInChI=1S/C14H25N5O/c1-9(2)12-16-7-10(18-15)11(17-12)13(20)19(6)8-14(3,4)5/h7,9,18H,8,15H2,1-6H3
InChIKeyVHZOXRXEYVVERT-UHFFFAOYSA-N
MW279.39 g/mol
LogP2.00
Rot. Bonds4

About N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide

N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide (PubChem CID 62243662) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide
PubChem CID62243662
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC NameN-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide
SMILESCC(C)c1ncc(NN)c(C(=O)N(C)CC(C)(C)C)n1
InChIInChI=1S/C14H25N5O/c1-9(2)12-16-7-10(18-15)11(17-12)13(20)19(6)8-14(3,4)5/h7,9,18H,8,15H2,1-6H3
InChIKeyVHZOXRXEYVVERT-UHFFFAOYSA-N
XLogP2.00
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide (CID 62243662) is N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide is CC(C)c1ncc(NN)c(C(=O)N(C)CC(C)(C)C)n1.
What is the InChIKey of N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide?
The InChIKey is VHZOXRXEYVVERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-9(2)12-16-7-10(18-15)11(17-12)13(20)19(6)8-14(3,4)5/h7,9,18H,8,15H2,1-6H3.
What are the key properties of N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide?
N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide has a molecular weight of 279.39 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-5-hydrazinyl-N-methyl-2-propan-2-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 62243662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).