N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide

C11H15N3O — CID 122263469

IUPACN-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide
SMILESCc1cc(CNC(=O)C2CCC2)ncn1
InChIInChI=1S/C11H15N3O/c1-8-5-10(14-7-13-8)6-12-11(15)9-3-2-4-9/h5,7,9H,2-4,6H2,1H3,(H,12,15)
InChIKeyWLYJDIHQFODOLK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.20
Rot. Bonds3

About N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide

N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide (PubChem CID 122263469) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide
PubChem CID122263469
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC NameN-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide
SMILESCc1cc(CNC(=O)C2CCC2)ncn1
InChIInChI=1S/C11H15N3O/c1-8-5-10(14-7-13-8)6-12-11(15)9-3-2-4-9/h5,7,9H,2-4,6H2,1H3,(H,12,15)
InChIKeyWLYJDIHQFODOLK-UHFFFAOYSA-N
XLogP1.20
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-methylpyrimidin-4-yl)methyl]acetamide
CID 122263436
N-[(6-phenylpyrimidin-4-yl)methyl]cyclopentanecarboxamide
CID 122261740
N-[(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)methyl]cyclobutanecarboxamide
CID 122352828
N-[[6-(4-methoxyphenyl)pyrimidin-4-yl]methyl]cyclohexanecarboxamide
CID 122262450
N-[2-[(6-methylpyrimidin-4-yl)amino]ethyl]cyclopropanecarboxamide
CID 115620732
N-[(6-methyl-2-pyridinyl)methyl]cyclopropanecarboxamide
CID 61150907
2-(2-methylphenyl)-N-[(6-methylpyrimidin-4-yl)methyl]acetamide
CID 122263387
4-methyl-N-[(6-methylpyrimidin-4-yl)methyl]-1,3-thiazole-5-carboxamide
CID 122263537
1-acetyl-N-[(6-phenylpyrimidin-4-yl)methyl]piperidine-4-carboxamide
CID 122261947
N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]cyclohexanecarboxamide
CID 16866590
N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]cyclohexanecarboxamide
CID 142586783
3-[(5-methyl-1,2-oxazol-3-yl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63783675

Frequently Asked Questions

What is the IUPAC name of N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide?
The IUPAC name of N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide (CID 122263469) is N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide?
The canonical SMILES for N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide is Cc1cc(CNC(=O)C2CCC2)ncn1.
What is the InChIKey of N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide?
The InChIKey is WLYJDIHQFODOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-5-10(14-7-13-8)6-12-11(15)9-3-2-4-9/h5,7,9H,2-4,6H2,1H3,(H,12,15).
What are the key properties of N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide?
N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide has a molecular weight of 205.26 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methylpyrimidin-4-yl)methyl]cyclobutanecarboxamide is sourced from PubChem (CID 122263469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).