N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine

C24H25N3O2 — CID 91220665

IUPACN-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine
SMILESCONC1=CCc2cc(-c3cc(C4CCNCC4)oc3-c3ccncc3)ccc21
InChIInChI=1S/C24H25N3O2/c1-28-27-22-5-3-18-14-19(2-4-20(18)22)21-15-23(16-6-10-25-11-7-16)29-24(21)17-8-12-26-13-9-17/h2,4-5,8-9,12-16,25,27H,3,6-7,10-11H2,1H3
InChIKeyISDIWBSFWXQXIQ-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.52
Rot. Bonds5

About N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine

N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine (PubChem CID 91220665) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine.

Molecular Properties

Compound NameN-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine
PubChem CID91220665
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC NameN-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine
SMILESCONC1=CCc2cc(-c3cc(C4CCNCC4)oc3-c3ccncc3)ccc21
InChIInChI=1S/C24H25N3O2/c1-28-27-22-5-3-18-14-19(2-4-20(18)22)21-15-23(16-6-10-25-11-7-16)29-24(21)17-8-12-26-13-9-17/h2,4-5,8-9,12-16,25,27H,3,6-7,10-11H2,1H3
InChIKeyISDIWBSFWXQXIQ-UHFFFAOYSA-N
XLogP4.52
TPSA59.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[1-(methoxyamino)-3H-inden-5-yl]-5-pyridin-4-ylfuran-2-carbaldehyde
CID 91057218
4-[2-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-5-piperidin-4-ylfuran-3-yl]pyridine
CID 91092541
5-[5-[1-(2-morpholin-4-ylethyl)piperidin-4-yl]-2-pyridin-4-ylfuran-3-yl]-2,3-dihydroinden-1-one
CID 91008901
5-[5-[1-[2-(dimethylamino)acetyl]piperidin-4-yl]-2-pyridin-4-ylfuran-3-yl]-2,3-dihydroinden-1-one
CID 69314809
(E)-N-methoxy-5-[5-(4-methoxyphenyl)-2-pyridin-4-ylfuran-3-yl]-2,3-dihydroinden-1-imine
CID 87832638
N'-hydroxy-2-[3-[4-(1-hydroxyimino-2,3-dihydroinden-5-yl)-5-pyridin-4-ylfuran-2-yl]piperidin-1-yl]ethanimidamide
CID 136635970
5-[5-[1-(cyclopropylmethyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-one
CID 91160419
4-[3-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-5-(1,2,3,6-tetrahydropyridin-4-yl)furan-2-yl]pyridine
CID 91403356
N-[5-[2-pyridin-4-yl-5-[4-(2-pyrrolidin-2-ylethoxy)phenyl]furan-3-yl]-2,3-dihydroinden-1-ylidene]hydroxylamine
CID 173218302
N-[[5-[(1E)-1-iodoimino-2,3-dihydroinden-5-yl]-4-pyridin-4-ylfuran-2-yl]methyl]-1-(2-methoxyethyl)piperidin-4-amine
CID 142219234
5-(3-methoxyphenyl)-4-piperidin-4-yl-2-pyridin-4-ylpyrimidine
CID 90058268
4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride
CID 23312240

Frequently Asked Questions

What is the IUPAC name of N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine?
The IUPAC name of N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine (CID 91220665) is N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine.
What is the SMILES notation for N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine?
The canonical SMILES for N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine is CONC1=CCc2cc(-c3cc(C4CCNCC4)oc3-c3ccncc3)ccc21.
What is the InChIKey of N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine?
The InChIKey is ISDIWBSFWXQXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-28-27-22-5-3-18-14-19(2-4-20(18)22)21-15-23(16-6-10-25-11-7-16)29-24(21)17-8-12-26-13-9-17/h2,4-5,8-9,12-16,25,27H,3,6-7,10-11H2,1H3.
What are the key properties of N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine?
N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine has a molecular weight of 387.48 g/mol, XLogP of 4.52, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-5-(5-piperidin-4-yl-2-pyridin-4-ylfuran-3-yl)-3H-inden-1-amine is sourced from PubChem (CID 91220665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).