7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine

C19H24N2O — CID 130217686

IUPAC7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
SMILESCOC1CCc2c(Nc3ccc(C(C)C)c(C)c3)ccnc21
InChIInChI=1S/C19H24N2O/c1-12(2)15-6-5-14(11-13(15)3)21-17-9-10-20-19-16(17)7-8-18(19)22-4/h5-6,9-12,18H,7-8H2,1-4H3,(H,20,21)
InChIKeyBZGUSFFZIDTHRD-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.89
Rot. Bonds4

About 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine

7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine (PubChem CID 130217686) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine.

Molecular Properties

Compound Name7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
PubChem CID130217686
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
SMILESCOC1CCc2c(Nc3ccc(C(C)C)c(C)c3)ccnc21
InChIInChI=1S/C19H24N2O/c1-12(2)15-6-5-14(11-13(15)3)21-17-9-10-20-19-16(17)7-8-18(19)22-4/h5-6,9-12,18H,7-8H2,1-4H3,(H,20,21)
InChIKeyBZGUSFFZIDTHRD-UHFFFAOYSA-N
XLogP4.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The IUPAC name of 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine (CID 130217686) is 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine.
What is the SMILES notation for 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The canonical SMILES for 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine is COC1CCc2c(Nc3ccc(C(C)C)c(C)c3)ccnc21.
What is the InChIKey of 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
The InChIKey is BZGUSFFZIDTHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-12(2)15-6-5-14(11-13(15)3)21-17-9-10-20-19-16(17)7-8-18(19)22-4/h5-6,9-12,18H,7-8H2,1-4H3,(H,20,21).
What are the key properties of 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine?
7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine has a molecular weight of 296.41 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(3-methyl-4-propan-2-ylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine is sourced from PubChem (CID 130217686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).