5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine

C10H16N4O — CID 83834197

IUPAC5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
SMILESCOc1c(C)ncnc1NC1CCNC1
InChIInChI=1S/C10H16N4O/c1-7-9(15-2)10(13-6-12-7)14-8-3-4-11-5-8/h6,8,11H,3-5H2,1-2H3,(H,12,13,14)
InChIKeyXIHFIXCJDVDRIZ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.57
Rot. Bonds3

About 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine

5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine (PubChem CID 83834197) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
PubChem CID83834197
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
SMILESCOc1c(C)ncnc1NC1CCNC1
InChIInChI=1S/C10H16N4O/c1-7-9(15-2)10(13-6-12-7)14-8-3-4-11-5-8/h6,8,11H,3-5H2,1-2H3,(H,12,13,14)
InChIKeyXIHFIXCJDVDRIZ-UHFFFAOYSA-N
XLogP0.57
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-5-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 66332962
5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 83844973
N-[(3R)-pyrrolidin-3-yl]pyrido[3,4-d]pyrimidin-4-amine
CID 141413091
N-[(3S)-pyrrolidin-3-yl]-7H-purin-6-amine
CID 140997133
5-chloro-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 105369904
3-bromo-4-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 106876094
3-methyl-N-piperidin-3-ylpyrazin-2-amine;hydrochloride
CID 71639312
3,5,6-trimethyl-2-N-[(3S)-pyrrolidin-3-yl]pyridine-2,4-diamine
CID 67444947
6-N-cyclobutyl-4-N-pyrrolidin-3-ylpyrimidine-4,6-diamine
CID 115264180
6-ethoxy-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 66319236
N-[(3S)-pyrrolidin-3-yl]furo[3,2-c]pyridin-4-amine
CID 129414245
6-(4-methoxyphenyl)-2-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 82191981

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
The IUPAC name of 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine (CID 83834197) is 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine.
What is the SMILES notation for 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
The canonical SMILES for 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine is COc1c(C)ncnc1NC1CCNC1.
What is the InChIKey of 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
The InChIKey is XIHFIXCJDVDRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-9(15-2)10(13-6-12-7)14-8-3-4-11-5-8/h6,8,11H,3-5H2,1-2H3,(H,12,13,14).
What are the key properties of 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine has a molecular weight of 208.26 g/mol, XLogP of 0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 83834197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).