N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide

C19H24N4O2 — CID 97234608

IUPACN-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide
SMILESCCOc1cncc(N2CCC[C@H](CNC(=O)c3ccccc3)C2)n1
InChIInChI=1S/C19H24N4O2/c1-2-25-18-13-20-12-17(22-18)23-10-6-7-15(14-23)11-21-19(24)16-8-4-3-5-9-16/h3-5,8-9,12-13,15H,2,6-7,10-11,14H2,1H3,(H,21,24)/t15-/m1/s1
InChIKeyXDLOEOKSXNOGDX-OAHLLOKOSA-N
MW340.43 g/mol
LogP2.52
Rot. Bonds6

About N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide

N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide (PubChem CID 97234608) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide
PubChem CID97234608
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide
SMILESCCOc1cncc(N2CCC[C@H](CNC(=O)c3ccccc3)C2)n1
InChIInChI=1S/C19H24N4O2/c1-2-25-18-13-20-12-17(22-18)23-10-6-7-15(14-23)11-21-19(24)16-8-4-3-5-9-16/h3-5,8-9,12-13,15H,2,6-7,10-11,14H2,1H3,(H,21,24)/t15-/m1/s1
InChIKeyXDLOEOKSXNOGDX-OAHLLOKOSA-N
XLogP2.52
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[(3R)-1-(6-ethoxypyrimidin-4-yl)piperidin-3-yl]methyl]benzamide
CID 99614878
N-[[(3S)-1-(3,6-dimethylpyrazin-2-yl)piperidin-3-yl]methyl]benzamide
CID 99855098
2-[[1-(6-ethoxy-2-pyridinyl)piperidin-3-yl]methylamino]acetic acid
CID 106814350
2-[3-(methoxymethyl)piperidin-1-yl]-6-phenylmethoxypyrazine
CID 75378157
N-methyl-1-(6-phenylmethoxypyrazin-2-yl)piperidine-3-carboxamide
CID 154750088
cyclopropyl-[4-(6-ethoxypyrazin-2-yl)-1,4-diazepan-1-yl]methanone
CID 133499195
1-[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]-1,2,4-triazole-3-carboxamide
CID 129488779
[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-phenylmethanone
CID 154862545
6-cyano-N-[(1-pyridin-2-ylpiperidin-3-yl)methyl]pyridine-3-carboxamide
CID 91844279
6-cyano-N-[[(3S)-1-pyridin-2-ylpiperidin-3-yl]methyl]pyridine-3-carboxamide
CID 124752431
2-[4-(6-ethoxypyrazin-2-yl)piperazin-1-yl]phenol
CID 75383880
N-[[1-(2-amino-3-methylpentanoyl)piperidin-3-yl]methyl]benzamide
CID 119766222

Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide?
The IUPAC name of N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide (CID 97234608) is N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide.
What is the SMILES notation for N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide?
The canonical SMILES for N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide is CCOc1cncc(N2CCC[C@H](CNC(=O)c3ccccc3)C2)n1.
What is the InChIKey of N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide?
The InChIKey is XDLOEOKSXNOGDX-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-2-25-18-13-20-12-17(22-18)23-10-6-7-15(14-23)11-21-19(24)16-8-4-3-5-9-16/h3-5,8-9,12-13,15H,2,6-7,10-11,14H2,1H3,(H,21,24)/t15-/m1/s1.
What are the key properties of N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide?
N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide has a molecular weight of 340.43 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]methyl]benzamide is sourced from PubChem (CID 97234608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).