N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide

C19H26N4O2 — CID 97201129

IUPACN-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide
SMILESCOCCn1cncc1CNC(=O)c1ccc([C@H]2CCCNC2)cc1
InChIInChI=1S/C19H26N4O2/c1-25-10-9-23-14-21-12-18(23)13-22-19(24)16-6-4-15(5-7-16)17-3-2-8-20-11-17/h4-7,12,14,17,20H,2-3,8-11,13H2,1H3,(H,22,24)/t17-/m0/s1
InChIKeyVJZYQIACSHSMRK-KRWDZBQOSA-N
MW342.44 g/mol
LogP1.93
Rot. Bonds7

About N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide

N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide (PubChem CID 97201129) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide.

Molecular Properties

Compound NameN-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide
PubChem CID97201129
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide
SMILESCOCCn1cncc1CNC(=O)c1ccc([C@H]2CCCNC2)cc1
InChIInChI=1S/C19H26N4O2/c1-25-10-9-23-14-21-12-18(23)13-22-19(24)16-6-4-15(5-7-16)17-3-2-8-20-11-17/h4-7,12,14,17,20H,2-3,8-11,13H2,1H3,(H,22,24)/t17-/m0/s1
InChIKeyVJZYQIACSHSMRK-KRWDZBQOSA-N
XLogP1.93
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]cyclopentanecarboxamide
CID 91774846
N-ethyl-4-piperidin-3-ylbenzamide
CID 172654355
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-(1-methyl-6-oxopyridazin-3-yl)benzamide
CID 122563016
N-(cyclopropylmethyl)-4-piperidin-3-ylbenzamide;hydrochloride
CID 172654364
N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-[(3S)-piperidin-3-yl]benzamide
CID 99939569
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-methyl-6-azaspiro[2.5]octane-2-carboxamide;dihydrochloride
CID 154921023
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 118788781
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-pyrrolidin-1-ylacetamide
CID 91777901
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-propan-2-ylpyrazole-3-carboxamide
CID 119066697
4-piperidin-3-yl-N-(2-pyrazin-2-ylethyl)benzamide
CID 72860445
4-[(3R)-piperidin-3-yl]-N-(2-pyrazin-2-ylethyl)benzamide
CID 97191641
N-[2-(1H-imidazol-5-yl)ethyl]-4-piperidin-3-ylbenzamide
CID 77082920

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide?
The IUPAC name of N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide (CID 97201129) is N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide.
What is the SMILES notation for N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide?
The canonical SMILES for N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide is COCCn1cncc1CNC(=O)c1ccc([C@H]2CCCNC2)cc1.
What is the InChIKey of N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide?
The InChIKey is VJZYQIACSHSMRK-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-25-10-9-23-14-21-12-18(23)13-22-19(24)16-6-4-15(5-7-16)17-3-2-8-20-11-17/h4-7,12,14,17,20H,2-3,8-11,13H2,1H3,(H,22,24)/t17-/m0/s1.
What are the key properties of N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide?
N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide has a molecular weight of 342.44 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-[(3R)-piperidin-3-yl]benzamide is sourced from PubChem (CID 97201129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).