5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine

C12H19N3O — CID 106660833

IUPAC5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine
SMILESCOc1cnc(C)cc1N(C)C1CCNC1
InChIInChI=1S/C12H19N3O/c1-9-6-11(12(16-3)8-14-9)15(2)10-4-5-13-7-10/h6,8,10,13H,4-5,7H2,1-3H3
InChIKeyKEKQKFAOXVMWIO-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.20
Rot. Bonds3

About 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine

5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine (PubChem CID 106660833) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine.

Molecular Properties

Compound Name5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine
PubChem CID106660833
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine
SMILESCOc1cnc(C)cc1N(C)C1CCNC1
InChIInChI=1S/C12H19N3O/c1-9-6-11(12(16-3)8-14-9)15(2)10-4-5-13-7-10/h6,8,10,13H,4-5,7H2,1-3H3
InChIKeyKEKQKFAOXVMWIO-UHFFFAOYSA-N
XLogP1.20
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(azetidin-3-yl)-N-ethyl-5-methoxy-2-methylpyridin-4-amine
CID 106660883
N-(2,4-dimethoxy-6-methylphenyl)-N-methylpyrrolidin-3-amine
CID 115118772
6-methoxy-N-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 66319644
N-(2-fluoro-5-methoxy-4-nitrophenyl)-N-methylpyrrolidin-3-amine
CID 107260460
N-(3-tert-butyl-4-methoxyphenyl)-N-methylpyrrolidin-3-amine
CID 115118686
N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine
CID 106552565
N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine
CID 78989080
N-methyl-N-(2-methyl-5-propan-2-ylphenyl)pyrrolidin-3-amine
CID 115118743
N-(4,5-dimethyl-2-nitrophenyl)-N-methylpyrrolidin-3-amine
CID 114281474
N-(4-tert-butyl-2-methylphenyl)-N-methylpyrrolidin-3-amine
CID 115118753
N,4-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71640984
2-chloro-N,6-dimethyl-N-[(3S)-pyrrolidin-3-yl]pyrimidin-4-amine
CID 71641175

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine?
The IUPAC name of 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine (CID 106660833) is 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine.
What is the SMILES notation for 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine?
The canonical SMILES for 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine is COc1cnc(C)cc1N(C)C1CCNC1.
What is the InChIKey of 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine?
The InChIKey is KEKQKFAOXVMWIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-6-11(12(16-3)8-14-9)15(2)10-4-5-13-7-10/h6,8,10,13H,4-5,7H2,1-3H3.
What are the key properties of 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine?
5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine is sourced from PubChem (CID 106660833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).