2-(3-methylbutan-2-yl)pyrimidine

C9H14N2 — CID 139342310

IUPAC2-(3-methylbutan-2-yl)pyrimidine
SMILESCC(C)C(C)c1ncccn1
InChIInChI=1S/C9H14N2/c1-7(2)8(3)9-10-5-4-6-11-9/h4-8H,1-3H3
InChIKeyYFUYDLAEAUCSMQ-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.24
Rot. Bonds2

About 2-(3-methylbutan-2-yl)pyrimidine

2-(3-methylbutan-2-yl)pyrimidine (PubChem CID 139342310) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-(3-methylbutan-2-yl)pyrimidine.

Molecular Properties

Compound Name2-(3-methylbutan-2-yl)pyrimidine
PubChem CID139342310
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name2-(3-methylbutan-2-yl)pyrimidine
SMILESCC(C)C(C)c1ncccn1
InChIInChI=1S/C9H14N2/c1-7(2)8(3)9-10-5-4-6-11-9/h4-8H,1-3H3
InChIKeyYFUYDLAEAUCSMQ-UHFFFAOYSA-N
XLogP2.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

fluoromethane;2-propan-2-ylpyrimidine
CID 161216719
N-ethyl-3-pyrimidin-2-ylbutan-2-amine
CID 63199557
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
(1R)-1-pyrimidin-2-ylethanamine;hydrochloride
CID 146680703
2-(3-pyrazin-2-ylbutan-2-yl)pyrimidine
CID 70954082
2-[(2R)-1,1,1-trifluoropropan-2-yl]pyrimidine
CID 68761664
3-pyrimidin-2-ylbutan-2-one
CID 63197013
2-(1-methylsulfanylpropan-2-yl)pyrimidine
CID 66920835
(1R,2R)-2-amino-1-pyrimidin-2-ylpropan-1-ol
CID 130900174
2-amino-1-pyrimidin-2-ylpropan-1-ol
CID 130985791
2-(dichloromethyl)pyrimidine
CID 68554638
2-methoxy-3-[(2R)-3-methylbutan-2-yl]pyridine
CID 176962095

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutan-2-yl)pyrimidine?
The IUPAC name of 2-(3-methylbutan-2-yl)pyrimidine (CID 139342310) is 2-(3-methylbutan-2-yl)pyrimidine.
What is the SMILES notation for 2-(3-methylbutan-2-yl)pyrimidine?
The canonical SMILES for 2-(3-methylbutan-2-yl)pyrimidine is CC(C)C(C)c1ncccn1.
What is the InChIKey of 2-(3-methylbutan-2-yl)pyrimidine?
The InChIKey is YFUYDLAEAUCSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7(2)8(3)9-10-5-4-6-11-9/h4-8H,1-3H3.
What are the key properties of 2-(3-methylbutan-2-yl)pyrimidine?
2-(3-methylbutan-2-yl)pyrimidine has a molecular weight of 150.22 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutan-2-yl)pyrimidine is sourced from PubChem (CID 139342310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).