1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide

C17H22N4O3 — CID 167930461

IUPAC1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide
SMILESCn1cnc(C(=O)Nc2ccc(OCCN3CCOCC3)cc2)c1
InChIInChI=1S/C17H22N4O3/c1-20-12-16(18-13-20)17(22)19-14-2-4-15(5-3-14)24-11-8-21-6-9-23-10-7-21/h2-5,12-13H,6-11H2,1H3,(H,19,22)
InChIKeyCGFRPDCWYSDLAW-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.38
Rot. Bonds6

About 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide

1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide (PubChem CID 167930461) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide
PubChem CID167930461
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide
SMILESCn1cnc(C(=O)Nc2ccc(OCCN3CCOCC3)cc2)c1
InChIInChI=1S/C17H22N4O3/c1-20-12-16(18-13-20)17(22)19-14-2-4-15(5-3-14)24-11-8-21-6-9-23-10-7-21/h2-5,12-13H,6-11H2,1H3,(H,19,22)
InChIKeyCGFRPDCWYSDLAW-UHFFFAOYSA-N
XLogP1.38
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-1,3-dimethyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide
CID 135253001
N-[4-(2-morpholin-4-ylethoxy)phenyl]-2-(oxetan-3-yl)acetamide
CID 167978203
2-methoxy-4-(1-methylpyrazol-4-yl)-N-[4-(2-morpholin-4-ylethoxy)phenyl]benzamide
CID 135144001
2-morpholin-4-ylethyl N-(4-octoxyphenyl)carbamate
CID 3087060
2-ethoxy-2-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]butanamide
CID 133246288
(2R)-2-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]-3-(3,4,5-trimethylpyrazol-1-yl)propanamide
CID 92596397
(2R)-2-cyclopropyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]-2-propoxypropanamide
CID 100717701
4-[2-(4-methylphenoxy)ethyl]morpholine;oxalic acid
CID 44827969
benzyl N-[4-(2-morpholin-4-ylethoxy)phenyl]carbamate;hydrochloride
CID 24836503
N-[4-(4-chloropyrazol-1-yl)phenyl]-4-(3-morpholin-4-ylpropoxy)benzamide
CID 156902307
4-methoxy-N-[4-(2-morpholin-4-ylethoxy)phenyl]-3-phenylmethoxybenzamide
CID 141436173
N-(4-methoxyphenyl)-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109207674

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide?
The IUPAC name of 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide (CID 167930461) is 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide?
The canonical SMILES for 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide is Cn1cnc(C(=O)Nc2ccc(OCCN3CCOCC3)cc2)c1.
What is the InChIKey of 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide?
The InChIKey is CGFRPDCWYSDLAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-20-12-16(18-13-20)17(22)19-14-2-4-15(5-3-14)24-11-8-21-6-9-23-10-7-21/h2-5,12-13H,6-11H2,1H3,(H,19,22).
What are the key properties of 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide?
1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-(2-morpholin-4-ylethoxy)phenyl]imidazole-4-carboxamide is sourced from PubChem (CID 167930461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).