N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide

C20H24N4O3 — CID 166315481

IUPACN-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide
SMILESO=C(Nc1cccc(C2CCOC2)c1)N1CCC(Oc2cnccn2)CC1
InChIInChI=1S/C20H24N4O3/c25-20(23-17-3-1-2-15(12-17)16-6-11-26-14-16)24-9-4-18(5-10-24)27-19-13-21-7-8-22-19/h1-3,7-8,12-13,16,18H,4-6,9-11,14H2,(H,23,25)
InChIKeyIFQJFGWDDRIAHV-UHFFFAOYSA-N
MW368.44 g/mol
LogP3.06
Rot. Bonds4

About N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide

N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide (PubChem CID 166315481) has the molecular formula C20H24N4O3 and a molecular weight of 368.44 g/mol. Its IUPAC name is N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide
PubChem CID166315481
Molecular FormulaC20H24N4O3
Molecular Weight368.44 g/mol
Exact Mass368.18
IUPAC NameN-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide
SMILESO=C(Nc1cccc(C2CCOC2)c1)N1CCC(Oc2cnccn2)CC1
InChIInChI=1S/C20H24N4O3/c25-20(23-17-3-1-2-15(12-17)16-6-11-26-14-16)24-9-4-18(5-10-24)27-19-13-21-7-8-22-19/h1-3,7-8,12-13,16,18H,4-6,9-11,14H2,(H,23,25)
InChIKeyIFQJFGWDDRIAHV-UHFFFAOYSA-N
XLogP3.06
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,6-difluorophenyl)-4-pyrazin-2-yloxypiperidine-1-carboxamide
CID 71799286
N-(4-chlorophenyl)-3-pyrazin-2-yloxypyrrolidine-1-carboxamide
CID 90636300
N-(2-methoxyphenyl)-4-pyrazin-2-yloxypiperidine-1-carboxamide
CID 90559095
N-(3-chlorophenyl)-4-pyridin-3-yloxypiperidine-1-carboxamide
CID 90566112
(3S)-3-pyrazin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
CID 100754062
(4-pyrazin-2-yloxypiperidin-1-yl)-pyridin-2-ylmethanone
CID 71799257
(2-nitrophenyl)-(4-pyrazin-2-yloxypiperidin-1-yl)methanone
CID 90559010
3-chloro-1-(4-pyrazin-2-yloxypiperidin-1-yl)propan-1-one
CID 90558978
(4-phenyloxan-4-yl)-[(3R)-3-pyrazin-2-yloxypyrrolidin-1-yl]methanone
CID 100753527
3-pyrazin-2-yloxypyrrolidine-1-carboxylic acid
CID 134496966
N-(3-methoxyphenyl)-4-(6-methylpyridazin-3-yl)oxypiperidine-1-carboxamide
CID 90559675
(5-phenyl-1,2-oxazol-3-yl)-(4-pyrazin-2-yloxypiperidin-1-yl)methanone
CID 71799248

Frequently Asked Questions

What is the IUPAC name of N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide?
The IUPAC name of N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide (CID 166315481) is N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide.
What is the SMILES notation for N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide?
The canonical SMILES for N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide is O=C(Nc1cccc(C2CCOC2)c1)N1CCC(Oc2cnccn2)CC1.
What is the InChIKey of N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide?
The InChIKey is IFQJFGWDDRIAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O3/c25-20(23-17-3-1-2-15(12-17)16-6-11-26-14-16)24-9-4-18(5-10-24)27-19-13-21-7-8-22-19/h1-3,7-8,12-13,16,18H,4-6,9-11,14H2,(H,23,25).
What are the key properties of N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide?
N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(oxolan-3-yl)phenyl]-4-pyrazin-2-yloxypiperidine-1-carboxamide is sourced from PubChem (CID 166315481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).