3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine

C10H14N2O — CID 118049997

IUPAC3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine
SMILESCOc1cc(C2CC(N)C2)ccn1
InChIInChI=1S/C10H14N2O/c1-13-10-6-7(2-3-12-10)8-4-9(11)5-8/h2-3,6,8-9H,4-5,11H2,1H3
InChIKeyVPSRSBKSYXNSFM-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.29
Rot. Bonds2

About 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine

3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine (PubChem CID 118049997) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine
PubChem CID118049997
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine
SMILESCOc1cc(C2CC(N)C2)ccn1
InChIInChI=1S/C10H14N2O/c1-13-10-6-7(2-3-12-10)8-4-9(11)5-8/h2-3,6,8-9H,4-5,11H2,1H3
InChIKeyVPSRSBKSYXNSFM-UHFFFAOYSA-N
XLogP1.29
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-[(2-methoxy-4-pyridinyl)methyl]-9-azabicyclo[3.3.1]nonan-3-amine
CID 62992716
3-(6,7-dimethoxyisoquinolin-1-yl)cyclobutan-1-amine
CID 116995190
ethane;methyl (2S)-3-[3-[[3-(2-methoxy-4-pyridinyl)cyclobutyl]methoxy]phenyl]-2-methylpropanoate
CID 144899366
(2S)-2-(2-methoxy-4-pyridinyl)-4-methylmorpholine
CID 177322318
2-(2-methoxy-4-pyridinyl)-4-methylmorpholine
CID 177322257
3-(7-methoxyisoquinolin-1-yl)cyclobutan-1-amine
CID 116995308
(2S,3R)-3-cyclopropyl-3-[3-[[3-(2-methoxy-4-pyridinyl)cyclobutyl]methoxy]phenyl]-2-methylpropanoic acid
CID 118296116
3-(3-bromophenyl)-N-[(2-methoxy-4-pyridinyl)methyl]cyclobutan-1-amine
CID 62992022
(4-aminopiperidin-1-yl)-(2-methoxy-4-pyridinyl)methanone
CID 121200428
CID 88855620
CID 88855620
2-(2-methoxy-4-pyridinyl)-4-methyl-1,4-oxazepane
CID 177322364
(1R)-1-(2-methoxy-4-pyridinyl)-2,2-dimethylpropan-1-amine
CID 130901703

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine?
The IUPAC name of 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine (CID 118049997) is 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine.
What is the SMILES notation for 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine?
The canonical SMILES for 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine is COc1cc(C2CC(N)C2)ccn1.
What is the InChIKey of 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine?
The InChIKey is VPSRSBKSYXNSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-13-10-6-7(2-3-12-10)8-4-9(11)5-8/h2-3,6,8-9H,4-5,11H2,1H3.
What are the key properties of 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine?
3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine has a molecular weight of 178.23 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-4-pyridinyl)cyclobutan-1-amine is sourced from PubChem (CID 118049997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).