1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine

C13H22N2O — CID 62601079

IUPAC1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine
SMILESCCCC(N)Cc1ncc(C)c(OC)c1C
InChIInChI=1S/C13H22N2O/c1-5-6-11(14)7-12-10(3)13(16-4)9(2)8-15-12/h8,11H,5-7,14H2,1-4H3
InChIKeyJWWYQZOLQDUISO-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.38
Rot. Bonds5

About 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine

1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine (PubChem CID 62601079) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine.

Molecular Properties

Compound Name1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine
PubChem CID62601079
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine
SMILESCCCC(N)Cc1ncc(C)c(OC)c1C
InChIInChI=1S/C13H22N2O/c1-5-6-11(14)7-12-10(3)13(16-4)9(2)8-15-12/h8,11H,5-7,14H2,1-4H3
InChIKeyJWWYQZOLQDUISO-UHFFFAOYSA-N
XLogP2.38
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methoxy-3,5-dimethyl-2-pyridinyl)octan-2-amine
CID 115844000
2-amino-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-1-ol
CID 64574563
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-(2-methoxyethoxy)butan-2-amine
CID 102927982
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pent-4-en-2-amine
CID 116660339
4,4,4-trifluoro-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)butan-2-amine
CID 55095222
1,1-dimethoxy-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propan-2-amine
CID 79493128
2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]butan-1-amine
CID 62505902
N-ethyl-3-methoxy-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)hexan-2-amine
CID 116719078
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-pyridin-3-ylpropan-2-amine
CID 62604362
2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-pyrimidin-5-ylethanamine
CID 102923368
3-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-N,3-N-dimethylpentane-2,3-diamine
CID 79058596
1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]pyrrol-3-yl]butan-1-amine
CID 79109512

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine?
The IUPAC name of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine (CID 62601079) is 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine.
What is the SMILES notation for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine?
The canonical SMILES for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine is CCCC(N)Cc1ncc(C)c(OC)c1C.
What is the InChIKey of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine?
The InChIKey is JWWYQZOLQDUISO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-5-6-11(14)7-12-10(3)13(16-4)9(2)8-15-12/h8,11H,5-7,14H2,1-4H3.
What are the key properties of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine?
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine has a molecular weight of 222.33 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)pentan-2-amine is sourced from PubChem (CID 62601079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).