N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide

C18H26N4O4 — CID 145279122

IUPACN-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide
SMILESCOc1c(OCCCN2CCOCC2)ccc(C2=NCCN2)c1NC=O
InChIInChI=1S/C18H26N4O4/c1-24-17-15(26-10-2-7-22-8-11-25-12-9-22)4-3-14(16(17)21-13-23)18-19-5-6-20-18/h3-4,13H,2,5-12H2,1H3,(H,19,20)(H,21,23)
InChIKeyCZLAOQATWIMFQO-UHFFFAOYSA-N
MW362.43 g/mol
LogP0.71
Rot. Bonds9

About N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide

N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide (PubChem CID 145279122) has the molecular formula C18H26N4O4 and a molecular weight of 362.43 g/mol. Its IUPAC name is N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide.

Molecular Properties

Compound NameN-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide
PubChem CID145279122
Molecular FormulaC18H26N4O4
Molecular Weight362.43 g/mol
Exact Mass362.20
IUPAC NameN-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide
SMILESCOc1c(OCCCN2CCOCC2)ccc(C2=NCCN2)c1NC=O
InChIInChI=1S/C18H26N4O4/c1-24-17-15(26-10-2-7-22-8-11-25-12-9-22)4-3-14(16(17)21-13-23)18-19-5-6-20-18/h3-4,13H,2,5-12H2,1H3,(H,19,20)(H,21,23)
InChIKeyCZLAOQATWIMFQO-UHFFFAOYSA-N
XLogP0.71
TPSA84.42 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]ethyl]morpholine
CID 82248212
4-methoxy-3-(3-morpholin-4-ylpropoxy)benzonitrile
CID 10356088
2-[7-methoxy-8-(3-morpholin-4-ylpropoxy)-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]-1,3-thiazole-4-carboxamide
CID 153424447
methyl 4-methoxy-3-(3-morpholin-4-ylpropoxy)benzoate
CID 22466648
6-[7-methoxy-8-(3-morpholin-4-ylpropoxy)-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]-2-methylpyridine-3-carboxamide
CID 153424434
4-[3-(2-methoxy-5-methylphenoxy)propyl]morpholine
CID 58597190
N-[4-[2-[4-methyl-3-(3-morpholin-4-ylpropoxy)phenyl]ethynyl]phenyl]formamide
CID 139417969
4-[3-(4-methoxyphenoxy)propyl]morpholine
CID 2053845
N-[7-methoxy-8-(3-morpholin-4-ylpropoxy)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyrazine-2-carboxamide
CID 135871073
4-methoxy-3-(2-morpholin-4-ylethoxy)benzaldehyde
CID 3251033
2-amino-N-[5-methoxy-2-methyl-6-(3-morpholin-4-ylpropoxy)-1-oxoisoquinolin-3-yl]pyrimidine-5-carboxamide
CID 154973696
(1E,4E)-1,5-bis[3-methoxy-4-(3-morpholin-4-ylpropoxy)phenyl]penta-1,4-dien-3-one
CID 127035896

Frequently Asked Questions

What is the IUPAC name of N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide?
The IUPAC name of N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide (CID 145279122) is N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide.
What is the SMILES notation for N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide?
The canonical SMILES for N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide is COc1c(OCCCN2CCOCC2)ccc(C2=NCCN2)c1NC=O.
What is the InChIKey of N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide?
The InChIKey is CZLAOQATWIMFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O4/c1-24-17-15(26-10-2-7-22-8-11-25-12-9-22)4-3-14(16(17)21-13-23)18-19-5-6-20-18/h3-4,13H,2,5-12H2,1H3,(H,19,20)(H,21,23).
What are the key properties of N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide?
N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide has a molecular weight of 362.43 g/mol, XLogP of 0.71, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-3-(3-morpholin-4-ylpropoxy)phenyl]formamide is sourced from PubChem (CID 145279122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).