2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine

C11H17N3O — CID 169307356

IUPAC2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine
SMILESCOc1ncc(CN2CCCC2C)cn1
InChIInChI=1S/C11H17N3O/c1-9-4-3-5-14(9)8-10-6-12-11(15-2)13-7-10/h6-7,9H,3-5,8H2,1-2H3
InChIKeyVUNMTSNFEZDMIM-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.47
Rot. Bonds3

About 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine

2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine (PubChem CID 169307356) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine.

Molecular Properties

Compound Name2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine
PubChem CID169307356
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine
SMILESCOc1ncc(CN2CCCC2C)cn1
InChIInChI=1S/C11H17N3O/c1-9-4-3-5-14(9)8-10-6-12-11(15-2)13-7-10/h6-7,9H,3-5,8H2,1-2H3
InChIKeyVUNMTSNFEZDMIM-UHFFFAOYSA-N
XLogP1.47
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[(2-methoxypyrimidin-5-yl)methyl]pyrrolidin-2-yl]cyclopropan-1-ol
CID 138384814
2-methoxy-5-[[(2S)-2-methylpiperidin-1-yl]methyl]pyridine
CID 95789080
2-methoxy-5-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]pyrimidine
CID 131932086
2-methoxy-5-(piperidin-1-ylmethyl)pyrimidine
CID 163258215
2-[methyl-[5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidin-2-yl]amino]acetic acid
CID 122563476
2-[methyl-[5-[[(2R)-2-methylpyrrolidin-1-yl]methyl]pyrimidin-2-yl]amino]acetic acid
CID 125441039
2-methoxy-5-[[(2S)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine
CID 95846033
3-[6-[1-[(2-methoxypyrimidin-5-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]propanamide
CID 110255862
4-[(2S)-1-[(2-methoxypyrimidin-5-yl)methyl]piperidin-2-yl]pyrimidin-2-amine
CID 125000364
2-chloro-4-[(2-methylpyrrolidin-1-yl)methyl]pyridine
CID 62471451
N-[4-[(2S)-1-[(2-methoxypyrimidin-5-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 125004240
1-[(3,5-dichlorophenyl)methyl]-2-methylpyrrolidine
CID 23566973

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine?
The IUPAC name of 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine (CID 169307356) is 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine.
What is the SMILES notation for 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine?
The canonical SMILES for 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine is COc1ncc(CN2CCCC2C)cn1.
What is the InChIKey of 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine?
The InChIKey is VUNMTSNFEZDMIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-4-3-5-14(9)8-10-6-12-11(15-2)13-7-10/h6-7,9H,3-5,8H2,1-2H3.
What are the key properties of 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine?
2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine has a molecular weight of 207.28 g/mol, XLogP of 1.47, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(2-methylpyrrolidin-1-yl)methyl]pyrimidine is sourced from PubChem (CID 169307356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).