N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide

C16H24N4O2 — CID 131911346

IUPACN-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide
SMILESO=C(NCC1CCN(c2cnccn2)CC1)C1CCOCC1
InChIInChI=1S/C16H24N4O2/c21-16(14-3-9-22-10-4-14)19-11-13-1-7-20(8-2-13)15-12-17-5-6-18-15/h5-6,12-14H,1-4,7-11H2,(H,19,21)
InChIKeyIQWZGAFTBDLUFO-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.24
Rot. Bonds4

About N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide

N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide (PubChem CID 131911346) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide
PubChem CID131911346
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide
SMILESO=C(NCC1CCN(c2cnccn2)CC1)C1CCOCC1
InChIInChI=1S/C16H24N4O2/c21-16(14-3-9-22-10-4-14)19-11-13-1-7-20(8-2-13)15-12-17-5-6-18-15/h5-6,12-14H,1-4,7-11H2,(H,19,21)
InChIKeyIQWZGAFTBDLUFO-UHFFFAOYSA-N
XLogP1.24
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]-9H-xanthene-9-carboxamide
CID 71786603
N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 38792432
N-prop-2-enyl-N'-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxamide
CID 121107808
tert-butyl N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]carbamate
CID 56965637
3-methyl-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]butanamide
CID 121109026
3-cyclopentyl-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]propanamide
CID 121109042
N-(oxan-4-ylmethyl)-1-pyrimidin-2-ylpyrrolidine-3-carboxamide
CID 110252079
N-[[1-(3-methylpyrazin-2-yl)piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 131950838
5-methyl-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]-1,2-oxazole-3-carboxamide
CID 71786546
N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxamide
CID 121107855
N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]cyclopropanamine
CID 62592661
N-[3-(azepan-1-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 86925418

Frequently Asked Questions

What is the IUPAC name of N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide?
The IUPAC name of N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide (CID 131911346) is N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide.
What is the SMILES notation for N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide?
The canonical SMILES for N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide is O=C(NCC1CCN(c2cnccn2)CC1)C1CCOCC1.
What is the InChIKey of N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide?
The InChIKey is IQWZGAFTBDLUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c21-16(14-3-9-22-10-4-14)19-11-13-1-7-20(8-2-13)15-12-17-5-6-18-15/h5-6,12-14H,1-4,7-11H2,(H,19,21).
What are the key properties of N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide?
N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]oxane-4-carboxamide is sourced from PubChem (CID 131911346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).