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

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Related Compounds

1-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119849090
1-amino-N-[6-[4-(trifluoromethyl)phenoxy]-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119878537
1-amino-N-[6-(4-methoxyphenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119893826
1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide
CID 119864117
1-amino-N-[[6-(4-fluorophenoxy)-3-pyridinyl]methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119847805
1-amino-N-(4-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119261942
1-amino-N-(6-fluoro-3-pyridinyl)cyclopentane-1-carboxamide
CID 103794921
4-(aminomethyl)-N-[6-(4-fluorophenoxy)-3-pyridinyl]oxane-4-carboxamide
CID 120939094
1-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]cyclohexane-1-carboxamide
CID 43704144
N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopropanecarboxamide
CID 117059029
1-amino-N-(3-pyrazin-2-yloxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119287655
N-[6-(4-fluorophenoxy)-3-pyridinyl]pyrrolidine-2-carboxamide
CID 119849104

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).