6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine

C12H20N4O — CID 104973053

IUPAC6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine
SMILESCOc1cc(NCC[C@H]2CCCN2)nc(C)n1
InChIInChI=1S/C12H20N4O/c1-9-15-11(8-12(16-9)17-2)14-7-5-10-4-3-6-13-10/h8,10,13H,3-7H2,1-2H3,(H,14,15,16)/t10-/m1/s1
InChIKeyWUJQZPVTPIIPCJ-SNVBAGLBSA-N
MW236.32 g/mol
LogP1.35
Rot. Bonds5

About 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine

6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine (PubChem CID 104973053) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine
PubChem CID104973053
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine
SMILESCOc1cc(NCC[C@H]2CCCN2)nc(C)n1
InChIInChI=1S/C12H20N4O/c1-9-15-11(8-12(16-9)17-2)14-7-5-10-4-3-6-13-10/h8,10,13H,3-7H2,1-2H3,(H,14,15,16)/t10-/m1/s1
InChIKeyWUJQZPVTPIIPCJ-SNVBAGLBSA-N
XLogP1.35
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 104972856
6-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973532
4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
CID 114794364
4-methoxy-3,5-dimethyl-N-(2-pyrrolidin-2-ylethyl)aniline
CID 115210173
6-methoxy-2-methyl-N-(3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 66327743
2-[(6-methoxy-2-methylpyrimidin-4-yl)amino]ethanol
CID 66325251
2-[[(6-methoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 66326314
2-ethyl-4-[2-[(2S)-pyrrolidin-2-yl]ethylamino]-1H-pyrimidin-6-one
CID 136879297
5-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrimidin-2-amine
CID 104973513
6-chloro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973220
5-methoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-2-amine
CID 104973111
N-[(4-ethylcyclohexyl)methyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66324640

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine?
The IUPAC name of 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine (CID 104973053) is 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine is COc1cc(NCC[C@H]2CCCN2)nc(C)n1.
What is the InChIKey of 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine?
The InChIKey is WUJQZPVTPIIPCJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9-15-11(8-12(16-9)17-2)14-7-5-10-4-3-6-13-10/h8,10,13H,3-7H2,1-2H3,(H,14,15,16)/t10-/m1/s1.
What are the key properties of 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine?
6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine is sourced from PubChem (CID 104973053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).