(2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide

C14H18N4O2 — CID 99824773

IUPAC(2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide
SMILESO=C(NCCc1nc2ccccc2[nH]1)[C@H]1CNCCO1
InChIInChI=1S/C14H18N4O2/c19-14(12-9-15-7-8-20-12)16-6-5-13-17-10-3-1-2-4-11(10)18-13/h1-4,12,15H,5-9H2,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyMJMSJUYWLZEUIX-GFCCVEGCSA-N
MW274.32 g/mol
LogP0.21
Rot. Bonds4

About (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide

(2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide (PubChem CID 99824773) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide
PubChem CID99824773
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name(2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide
SMILESO=C(NCCc1nc2ccccc2[nH]1)[C@H]1CNCCO1
InChIInChI=1S/C14H18N4O2/c19-14(12-9-15-7-8-20-12)16-6-5-13-17-10-3-1-2-4-11(10)18-13/h1-4,12,15H,5-9H2,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyMJMSJUYWLZEUIX-GFCCVEGCSA-N
XLogP0.21
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1H-benzimidazol-2-yl)propyl]morpholine-2-carboxamide
CID 119838296
N-[2-(1H-benzimidazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide
CID 79671903
N-(1H-benzimidazol-2-ylmethyl)-1,4-dioxane-2-carboxamide
CID 47178137
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)morpholine-2-carboxamide;dihydrochloride
CID 119840691
(2R)-N-(2-butyl-3H-benzimidazol-5-yl)morpholine-2-carboxamide
CID 126779606
N-[2-(1H-benzimidazol-2-yl)ethyl]bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 43229191
N-(2-benzamidoethyl)morpholine-2-carboxamide;hydrochloride
CID 119702761
trans-(1R,2R)-N-[3-(1H-benzimidazol-2-yl)propyl]-2-methylcyclopropane-1-carboxamide
CID 29303561
(1S,2R,4S)-N-[2-(1H-benzimidazol-2-yl)ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 98680037
1-acetyl-N-[2-(1H-benzimidazol-2-yl)ethyl]piperidine-4-carboxamide
CID 110741848
N-[3-(1H-benzimidazol-2-yl)propyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 134032826
(3R,4S)-N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide
CID 120938193

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
The IUPAC name of (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide (CID 99824773) is (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide is O=C(NCCc1nc2ccccc2[nH]1)[C@H]1CNCCO1.
What is the InChIKey of (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
The InChIKey is MJMSJUYWLZEUIX-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H18N4O2/c19-14(12-9-15-7-8-20-12)16-6-5-13-17-10-3-1-2-4-11(10)18-13/h1-4,12,15H,5-9H2,(H,16,19)(H,17,18)/t12-/m1/s1.
What are the key properties of (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
(2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 0.21, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(1H-benzimidazol-2-yl)ethyl]morpholine-2-carboxamide is sourced from PubChem (CID 99824773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).