1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide

C17H18ClN3O2 — CID 119864117

IUPAC1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCCC1
InChIInChI=1S/C17H18ClN3O2/c18-12-3-8-15(20-11-12)23-14-6-4-13(5-7-14)21-16(22)17(19)9-1-2-10-17/h3-8,11H,1-2,9-10,19H2,(H,21,22)
InChIKeyUHGNJZSSFSIAET-UHFFFAOYSA-N
MW331.80 g/mol
LogP3.74
Rot. Bonds4

About 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide

1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide (PubChem CID 119864117) has the molecular formula C17H18ClN3O2 and a molecular weight of 331.80 g/mol. Its IUPAC name is 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide
PubChem CID119864117
Molecular FormulaC17H18ClN3O2
Molecular Weight331.80 g/mol
Exact Mass331.11
IUPAC Name1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCCC1
InChIInChI=1S/C17H18ClN3O2/c18-12-3-8-15(20-11-12)23-14-6-4-13(5-7-14)21-16(22)17(19)9-1-2-10-17/h3-8,11H,1-2,9-10,19H2,(H,21,22)
InChIKeyUHGNJZSSFSIAET-UHFFFAOYSA-N
XLogP3.74
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.80
LogP ≤ 53.74
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-fluorophenoxy)-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119849089
1-amino-N-[6-(4-methoxyphenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119893826
1-amino-N-[6-[4-(trifluoromethyl)phenoxy]-3-pyridinyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119878537
N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111540621
3-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]-2-methylbutanamide
CID 120503351
1-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]cyclohexane-1-carboxamide
CID 43704144
N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]-2-ethoxyacetamide
CID 71994232
N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]piperidine-4-carboxamide;dihydrochloride
CID 119864102
6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide
CID 166216580
1-amino-N-[4-(4-methylpyrimidin-2-yl)oxyphenyl]cyclopentane-1-carboxamide
CID 119340030
1-[[4-[(5-chloro-2-pyridinyl)oxy]phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122085769

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide (CID 119864117) is 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide is NC1(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCCC1.
What is the InChIKey of 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide?
The InChIKey is UHGNJZSSFSIAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O2/c18-12-3-8-15(20-11-12)23-14-6-4-13(5-7-14)21-16(22)17(19)9-1-2-10-17/h3-8,11H,1-2,9-10,19H2,(H,21,22).
What are the key properties of 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide?
1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide has a molecular weight of 331.80 g/mol, XLogP of 3.74, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119864117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).