N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide

C22H27N3O2 — CID 123893223

IUPACN-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
SMILESCOc1ccc(N2CCC(N(C)C(=O)c3ccc4c(c3)CCC4)CC2)cn1
InChIInChI=1S/C22H27N3O2/c1-24(22(26)18-7-6-16-4-3-5-17(16)14-18)19-10-12-25(13-11-19)20-8-9-21(27-2)23-15-20/h6-9,14-15,19H,3-5,10-13H2,1-2H3
InChIKeyMLMIHFFHIBZTOW-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.32
Rot. Bonds4

About N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide

N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide (PubChem CID 123893223) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide.

Molecular Properties

Compound NameN-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
PubChem CID123893223
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
SMILESCOc1ccc(N2CCC(N(C)C(=O)c3ccc4c(c3)CCC4)CC2)cn1
InChIInChI=1S/C22H27N3O2/c1-24(22(26)18-7-6-16-4-3-5-17(16)14-18)19-10-12-25(13-11-19)20-8-9-21(27-2)23-15-20/h6-9,14-15,19H,3-5,10-13H2,1-2H3
InChIKeyMLMIHFFHIBZTOW-UHFFFAOYSA-N
XLogP3.32
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide?
The IUPAC name of N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide (CID 123893223) is N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide.
What is the SMILES notation for N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide?
The canonical SMILES for N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide is COc1ccc(N2CCC(N(C)C(=O)c3ccc4c(c3)CCC4)CC2)cn1.
What is the InChIKey of N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide?
The InChIKey is MLMIHFFHIBZTOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-24(22(26)18-7-6-16-4-3-5-17(16)14-18)19-10-12-25(13-11-19)20-8-9-21(27-2)23-15-20/h6-9,14-15,19H,3-5,10-13H2,1-2H3.
What are the key properties of N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide?
N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methoxy-3-pyridinyl)piperidin-4-yl]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide is sourced from PubChem (CID 123893223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).