N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide

C16H20N4O3 — CID 119862204

IUPACN-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide
SMILESO=C(Nc1ccccc1OCCn1ccnc1)C1CNCCO1
InChIInChI=1S/C16H20N4O3/c21-16(15-11-17-6-9-22-15)19-13-3-1-2-4-14(13)23-10-8-20-7-5-18-12-20/h1-5,7,12,15,17H,6,8-11H2,(H,19,21)
InChIKeyLXKLWBYADHYOTP-UHFFFAOYSA-N
MW316.36 g/mol
LogP0.89
Rot. Bonds6

About N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide

N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide (PubChem CID 119862204) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide
PubChem CID119862204
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC NameN-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide
SMILESO=C(Nc1ccccc1OCCn1ccnc1)C1CNCCO1
InChIInChI=1S/C16H20N4O3/c21-16(15-11-17-6-9-22-15)19-13-3-1-2-4-14(13)23-10-8-20-7-5-18-12-20/h1-5,7,12,15,17H,6,8-11H2,(H,19,21)
InChIKeyLXKLWBYADHYOTP-UHFFFAOYSA-N
XLogP0.89
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(2-imidazol-1-ylethoxy)phenyl]piperidine-3-carboxamide
CID 119862178
5-cyclopropyl-N-[2-(2-imidazol-1-ylethoxy)phenyl]pyrazolidine-3-carboxamide
CID 75613738
2-(cyclopropylmethylamino)-N-[2-(2-imidazol-1-ylethoxy)phenyl]acetamide;dihydrochloride
CID 119862195
N-[2-[(2-methylpropan-2-yl)oxy]phenyl]morpholine-2-carboxamide;hydrochloride
CID 119792290
(E)-3-(4-fluorophenyl)-N-[2-(2-imidazol-1-ylethoxy)phenyl]prop-2-enamide
CID 47789776
N-[2-(2-imidazol-1-ylethoxy)phenyl]-4-phenylbenzamide
CID 47789751
(2S)-N-[2-[(2-methylimidazol-1-yl)methyl]phenyl]morpholine-2-carboxamide
CID 95896960
N-[2-(2-imidazol-1-ylethoxy)phenyl]-2-(trifluoromethylsulfanyl)acetamide
CID 47789441
3-amino-N-[2-(2-imidazol-1-ylethoxy)phenyl]-2-methylbutanamide;dihydrochloride
CID 120503297
N-(2-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679075
1-[2-(2-imidazol-1-ylethoxy)phenyl]-3-thiophen-3-ylurea
CID 99833540
N-[2-(1-phenylethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119792514

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide?
The IUPAC name of N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide (CID 119862204) is N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide is O=C(Nc1ccccc1OCCn1ccnc1)C1CNCCO1.
What is the InChIKey of N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide?
The InChIKey is LXKLWBYADHYOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c21-16(15-11-17-6-9-22-15)19-13-3-1-2-4-14(13)23-10-8-20-7-5-18-12-20/h1-5,7,12,15,17H,6,8-11H2,(H,19,21).
What are the key properties of N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide?
N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide has a molecular weight of 316.36 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-imidazol-1-ylethoxy)phenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119862204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).