4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide

C10H15N3O — CID 67815665

IUPAC4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide
SMILESCc1nc(C(N)=O)nc(C)c1C(C)C
InChIInChI=1S/C10H15N3O/c1-5(2)8-6(3)12-10(9(11)14)13-7(8)4/h5H,1-4H3,(H2,11,14)
InChIKeyQEVXSCMFWYCZKZ-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.32
Rot. Bonds2

About 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide

4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide (PubChem CID 67815665) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide
PubChem CID67815665
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide
SMILESCc1nc(C(N)=O)nc(C)c1C(C)C
InChIInChI=1S/C10H15N3O/c1-5(2)8-6(3)12-10(9(11)14)13-7(8)4/h5H,1-4H3,(H2,11,14)
InChIKeyQEVXSCMFWYCZKZ-UHFFFAOYSA-N
XLogP1.32
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide?
The IUPAC name of 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide (CID 67815665) is 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide.
What is the SMILES notation for 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide?
The canonical SMILES for 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide is Cc1nc(C(N)=O)nc(C)c1C(C)C.
What is the InChIKey of 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide?
The InChIKey is QEVXSCMFWYCZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-5(2)8-6(3)12-10(9(11)14)13-7(8)4/h5H,1-4H3,(H2,11,14).
What are the key properties of 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide?
4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide has a molecular weight of 193.25 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-5-propan-2-ylpyrimidine-2-carboxamide is sourced from PubChem (CID 67815665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).