N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide

C18H20N4O3 — CID 119872961

IUPACN-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide
SMILESNC(=O)c1cccc(Oc2ccc(NC(=O)C3CCCNC3)cn2)c1
InChIInChI=1S/C18H20N4O3/c19-17(23)12-3-1-5-15(9-12)25-16-7-6-14(11-21-16)22-18(24)13-4-2-8-20-10-13/h1,3,5-7,9,11,13,20H,2,4,8,10H2,(H2,19,23)(H,22,24)
InChIKeyHVVWMZIKTJFSRA-UHFFFAOYSA-N
MW340.38 g/mol
LogP1.91
Rot. Bonds5

About N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide

N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide (PubChem CID 119872961) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide
PubChem CID119872961
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC NameN-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide
SMILESNC(=O)c1cccc(Oc2ccc(NC(=O)C3CCCNC3)cn2)c1
InChIInChI=1S/C18H20N4O3/c19-17(23)12-3-1-5-15(9-12)25-16-7-6-14(11-21-16)22-18(24)13-4-2-8-20-10-13/h1,3,5-7,9,11,13,20H,2,4,8,10H2,(H2,19,23)(H,22,24)
InChIKeyHVVWMZIKTJFSRA-UHFFFAOYSA-N
XLogP1.91
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(3-ethylphenoxy)-3-pyridinyl]piperidine-3-carboxamide;dihydrochloride
CID 119858521
N-[6-(4-chlorophenoxy)-3-pyridinyl]piperidine-3-carboxamide
CID 119864063
3-[[5-[[(1S,2R)-2-cyclopropylcyclopropanecarbonyl]amino]-2-pyridinyl]oxy]benzamide
CID 97011616
N-[6-(2,3-dimethylphenoxy)-3-pyridinyl]piperidine-3-carboxamide
CID 119888472
N-[6-(3-carbamoylphenoxy)-3-pyridinyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119872975
3-amino-N-[6-(3-carbamoylphenoxy)-3-pyridinyl]bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
CID 119872968
3-[[5-(3-piperidin-4-ylbutanoylamino)-2-pyridinyl]oxy]benzamide;dihydrochloride
CID 119872984
N-(6-chloro-3-pyridinyl)piperidine-3-carboxamide
CID 81426071
N-(3-prop-2-enoxyphenyl)piperidine-3-carboxamide;hydrochloride
CID 119303125
N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119299176
N-[3-(2,2,2-trifluoroethoxy)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119291452
N-[[6-(3-methoxyphenoxy)-3-pyridinyl]methyl]piperidine-3-carboxamide;dihydrochloride
CID 119847592

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide?
The IUPAC name of N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide (CID 119872961) is N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide?
The canonical SMILES for N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide is NC(=O)c1cccc(Oc2ccc(NC(=O)C3CCCNC3)cn2)c1.
What is the InChIKey of N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide?
The InChIKey is HVVWMZIKTJFSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3/c19-17(23)12-3-1-5-15(9-12)25-16-7-6-14(11-21-16)22-18(24)13-4-2-8-20-10-13/h1,3,5-7,9,11,13,20H,2,4,8,10H2,(H2,19,23)(H,22,24).
What are the key properties of N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide?
N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide has a molecular weight of 340.38 g/mol, XLogP of 1.91, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-carbamoylphenoxy)-3-pyridinyl]piperidine-3-carboxamide is sourced from PubChem (CID 119872961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).