1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride

C17H20Cl2FN3O2 — CID 119849089

IUPAC1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
SMILESCl.Cl.NC1(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)CCCC1
InChIInChI=1S/C17H18FN3O2.2ClH/c18-12-3-6-14(7-4-12)23-15-8-5-13(11-20-15)21-16(22)17(19)9-1-2-10-17;;/h3-8,11H,1-2,9-10,19H2,(H,21,22);2*1H
InChIKeyRWLAVVWLROQJSZ-UHFFFAOYSA-N
MW388.27 g/mol
LogP4.07
Rot. Bonds4

About 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride

1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride (PubChem CID 119849089) has the molecular formula C17H20Cl2FN3O2 and a molecular weight of 388.27 g/mol. Its IUPAC name is 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride.

Molecular Properties

Compound Name1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
PubChem CID119849089
Molecular FormulaC17H20Cl2FN3O2
Molecular Weight388.27 g/mol
Exact Mass387.09
IUPAC Name1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
SMILESCl.Cl.NC1(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)CCCC1
InChIInChI=1S/C17H18FN3O2.2ClH/c18-12-3-6-14(7-4-12)23-15-8-5-13(11-20-15)21-16(22)17(19)9-1-2-10-17;;/h3-8,11H,1-2,9-10,19H2,(H,21,22);2*1H
InChIKeyRWLAVVWLROQJSZ-UHFFFAOYSA-N
XLogP4.07
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.27
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride?
The IUPAC name of 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride (CID 119849089) is 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride.
What is the SMILES notation for 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride?
The canonical SMILES for 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride is Cl.Cl.NC1(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)CCCC1.
What is the InChIKey of 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride?
The InChIKey is RWLAVVWLROQJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O2.2ClH/c18-12-3-6-14(7-4-12)23-15-8-5-13(11-20-15)21-16(22)17(19)9-1-2-10-17;;/h3-8,11H,1-2,9-10,19H2,(H,21,22);2*1H.
What are the key properties of 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride?
1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride has a molecular weight of 388.27 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride is sourced from PubChem (CID 119849089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).