4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine

C9H15N5O — CID 175996544

IUPAC4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine
SMILESCNc1cc(OC2CCNC2)nc(N)n1
InChIInChI=1S/C9H15N5O/c1-11-7-4-8(14-9(10)13-7)15-6-2-3-12-5-6/h4,6,12H,2-3,5H2,1H3,(H3,10,11,13,14)
InChIKeyVNMNNXMNXGRGLR-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.16
Rot. Bonds3

About 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine

4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine (PubChem CID 175996544) has the molecular formula C9H15N5O and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine
PubChem CID175996544
Molecular FormulaC9H15N5O
Molecular Weight209.25 g/mol
Exact Mass209.13
IUPAC Name4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine
SMILESCNc1cc(OC2CCNC2)nc(N)n1
InChIInChI=1S/C9H15N5O/c1-11-7-4-8(14-9(10)13-7)15-6-2-3-12-5-6/h4,6,12H,2-3,5H2,1H3,(H3,10,11,13,14)
InChIKeyVNMNNXMNXGRGLR-UHFFFAOYSA-N
XLogP-0.16
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-4-pyrrolidin-3-yloxypyrimidin-2-amine
CID 175996386
2-chloro-4-methyl-6-pyrrolidin-3-yloxypyrimidine;hydrochloride
CID 71638580
6-cycloheptyloxy-4-N-ethylpyrimidine-2,4-diamine
CID 80870965
6-[chloro(difluoro)methoxy]-4-N-methylpyrimidine-2,4-diamine
CID 23358647
2-methyl-6-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 94406823
4-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyridine;hydrochloride
CID 71638571
3-methyl-6-[(3S)-pyrrolidin-3-yl]oxypyridazine
CID 71638804
(3S)-3-(3,5-dimethylphenoxy)pyrrolidine
CID 26192104
4-chloro-6-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyrimidine;hydrochloride
CID 71638490
2-cyclopropyl-6-(3,4-dimethylcyclohexyl)oxy-N-methylpyrimidin-4-amine
CID 80962626
2-chloro-6-pyrrolidin-3-yloxypyridine
CID 87733197
4-N-methyl-6-(2-methylbutan-2-yloxy)pyrimidine-2,4-diamine
CID 80861815

Frequently Asked Questions

What is the IUPAC name of 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine?
The IUPAC name of 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine (CID 175996544) is 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine?
The canonical SMILES for 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine is CNc1cc(OC2CCNC2)nc(N)n1.
What is the InChIKey of 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine?
The InChIKey is VNMNNXMNXGRGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O/c1-11-7-4-8(14-9(10)13-7)15-6-2-3-12-5-6/h4,6,12H,2-3,5H2,1H3,(H3,10,11,13,14).
What are the key properties of 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine?
4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine has a molecular weight of 209.25 g/mol, XLogP of -0.16, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-methyl-6-pyrrolidin-3-yloxypyrimidine-2,4-diamine is sourced from PubChem (CID 175996544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).