(Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine

C18H26N4O2 — CID 137396409

IUPAC(Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine
SMILESCC(N)/C=C\Cn1cnc2cc(OCCN3CCOCC3)ccc21
InChIInChI=1S/C18H26N4O2/c1-15(19)3-2-6-22-14-20-17-13-16(4-5-18(17)22)24-12-9-21-7-10-23-11-8-21/h2-5,13-15H,6-12,19H2,1H3/b3-2-
InChIKeyHJOGLYUEYLJHMT-IHWYPQMZSA-N
MW330.43 g/mol
LogP1.65
Rot. Bonds7

About (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine

(Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine (PubChem CID 137396409) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine.

Molecular Properties

Compound Name(Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine
PubChem CID137396409
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name(Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine
SMILESCC(N)/C=C\Cn1cnc2cc(OCCN3CCOCC3)ccc21
InChIInChI=1S/C18H26N4O2/c1-15(19)3-2-6-22-14-20-17-13-16(4-5-18(17)22)24-12-9-21-7-10-23-11-8-21/h2-5,13-15H,6-12,19H2,1H3/b3-2-
InChIKeyHJOGLYUEYLJHMT-IHWYPQMZSA-N
XLogP1.65
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 3386987
1-[5-(2-morpholin-4-ylethoxy)-2-pyridinyl]butan-2-amine
CID 79796010
1-[4-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 43503698
4-[2-(3-butoxyphenoxy)ethyl]morpholine
CID 2993436
4-[2-(3-methylpyrazolo[1,5-a]pyridin-6-yl)oxyethyl]morpholine
CID 155727791
5-amino-3-tert-butyl-N-[4-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]phenyl]pyrazole-1-carboxamide
CID 130424549
4-[2-(1-propan-2-ylpyrazol-4-yl)oxyethyl]morpholine
CID 116805370
4-(2-morpholin-4-ylethoxy)aniline;hydrochloride
CID 89422137
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
1-[3-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 43504270
methyl 2-[2-methyl-4-(2-morpholin-4-ylethoxy)phenyl]propanoate
CID 143419572
4-[1-(2-methylpropyl)-5-(3-morpholin-4-ylpropoxy)benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
CID 59011565

Frequently Asked Questions

What is the IUPAC name of (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine?
The IUPAC name of (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine (CID 137396409) is (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine.
What is the SMILES notation for (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine?
The canonical SMILES for (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine is CC(N)/C=C\Cn1cnc2cc(OCCN3CCOCC3)ccc21.
What is the InChIKey of (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine?
The InChIKey is HJOGLYUEYLJHMT-IHWYPQMZSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-15(19)3-2-6-22-14-20-17-13-16(4-5-18(17)22)24-12-9-21-7-10-23-11-8-21/h2-5,13-15H,6-12,19H2,1H3/b3-2-.
What are the key properties of (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine?
(Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine has a molecular weight of 330.43 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-[5-(2-morpholin-4-ylethoxy)benzimidazol-1-yl]pent-3-en-2-amine is sourced from PubChem (CID 137396409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).