N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide

C13H16N4O2 — CID 110869159

IUPACN-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide
SMILESCn1cnc2cc(NC(=O)N3CCOCC3)ccc21
InChIInChI=1S/C13H16N4O2/c1-16-9-14-11-8-10(2-3-12(11)16)15-13(18)17-4-6-19-7-5-17/h2-3,8-9H,4-7H2,1H3,(H,15,18)
InChIKeyNLWVBXKWSQXLCE-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.44
Rot. Bonds1

About N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide

N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide (PubChem CID 110869159) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide
PubChem CID110869159
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC NameN-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide
SMILESCn1cnc2cc(NC(=O)N3CCOCC3)ccc21
InChIInChI=1S/C13H16N4O2/c1-16-9-14-11-8-10(2-3-12(11)16)15-13(18)17-4-6-19-7-5-17/h2-3,8-9H,4-7H2,1H3,(H,15,18)
InChIKeyNLWVBXKWSQXLCE-UHFFFAOYSA-N
XLogP1.44
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-dimethyl-N-(1-methylbenzimidazol-5-yl)-2,4-dioxo-1,3,8-triazaspiro[4.5]decane-8-carboxamide
CID 118770452
(1-methylbenzimidazol-5-yl)urea
CID 12521213
N-(1-methylbenzimidazol-5-yl)-2-oxopropanamide
CID 115175378
N-(1-methylbenzimidazol-5-yl)cyclopropanecarboxamide
CID 110728508
N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
N-(2-methyl-1,3-dioxoisoindol-5-yl)morpholine-4-carboxamide
CID 24664341
N-(4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)morpholine-4-carboxamide
CID 110639589
2-[(1-methylbenzimidazol-5-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 115165335
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
N-(4-methoxy-3-methylphenyl)morpholine-4-carboxamide
CID 47322511
N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide
CID 47410728
2-(4-fluorophenyl)-N-(1-methylbenzimidazol-5-yl)acetamide
CID 110728531

Frequently Asked Questions

What is the IUPAC name of N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide?
The IUPAC name of N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide (CID 110869159) is N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide is Cn1cnc2cc(NC(=O)N3CCOCC3)ccc21.
What is the InChIKey of N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide?
The InChIKey is NLWVBXKWSQXLCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-16-9-14-11-8-10(2-3-12(11)16)15-13(18)17-4-6-19-7-5-17/h2-3,8-9H,4-7H2,1H3,(H,15,18).
What are the key properties of N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide?
N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylbenzimidazol-5-yl)morpholine-4-carboxamide is sourced from PubChem (CID 110869159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).