1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide

C14H20N2O2 — CID 138014884

IUPAC1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide
SMILESCCCNC(=O)C1(N)CCc2c(OC)cccc21
InChIInChI=1S/C14H20N2O2/c1-3-9-16-13(17)14(15)8-7-10-11(14)5-4-6-12(10)18-2/h4-6H,3,7-9,15H2,1-2H3,(H,16,17)
InChIKeyRTARFFVRGHOJLN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.32
Rot. Bonds4

About 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide

1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide (PubChem CID 138014884) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide.

Molecular Properties

Compound Name1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide
PubChem CID138014884
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide
SMILESCCCNC(=O)C1(N)CCc2c(OC)cccc21
InChIInChI=1S/C14H20N2O2/c1-3-9-16-13(17)14(15)8-7-10-11(14)5-4-6-12(10)18-2/h4-6H,3,7-9,15H2,1-2H3,(H,16,17)
InChIKeyRTARFFVRGHOJLN-UHFFFAOYSA-N
XLogP1.32
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide?
The IUPAC name of 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide (CID 138014884) is 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide.
What is the SMILES notation for 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide?
The canonical SMILES for 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide is CCCNC(=O)C1(N)CCc2c(OC)cccc21.
What is the InChIKey of 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide?
The InChIKey is RTARFFVRGHOJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-9-16-13(17)14(15)8-7-10-11(14)5-4-6-12(10)18-2/h4-6H,3,7-9,15H2,1-2H3,(H,16,17).
What are the key properties of 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide?
1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-methoxy-N-propyl-2,3-dihydroindene-1-carboxamide is sourced from PubChem (CID 138014884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).