[4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine

C21H28N4 — CID 145324349

IUPAC[4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine
SMILES[H]/N=C(/c1ccc(CN2CCN3C2=CC=CC3CC)cc1)N1CCCC1
InChIInChI=1S/C21H28N4/c1-2-19-6-5-7-20-24(14-15-25(19)20)16-17-8-10-18(11-9-17)21(22)23-12-3-4-13-23/h5-11,19,22H,2-4,12-16H2,1H3/b22-21-
InChIKeyBJURCXWSJTVGHO-DQRAZIAOSA-N
MW336.48 g/mol
LogP3.42
Rot. Bonds4

About [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine

[4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine (PubChem CID 145324349) has the molecular formula C21H28N4 and a molecular weight of 336.48 g/mol. Its IUPAC name is [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine.

Molecular Properties

Compound Name[4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine
PubChem CID145324349
Molecular FormulaC21H28N4
Molecular Weight336.48 g/mol
Exact Mass336.23
IUPAC Name[4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine
SMILES[H]/N=C(/c1ccc(CN2CCN3C2=CC=CC3CC)cc1)N1CCCC1
InChIInChI=1S/C21H28N4/c1-2-19-6-5-7-20-24(14-15-25(19)20)16-17-8-10-18(11-9-17)21(22)23-12-3-4-13-23/h5-11,19,22H,2-4,12-16H2,1H3/b22-21-
InChIKeyBJURCXWSJTVGHO-DQRAZIAOSA-N
XLogP3.42
TPSA33.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-5-fluoro-4-[(5-propyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]benzenecarboximidamide
CID 129239007
(2E)-2-[(3Z)-3-ethylidene-1-[[4-(piperidine-1-carboximidoyl)phenyl]methyl]pyrrol-2-ylidene]-N-methylethanimine
CID 129229788
(3-chloro-4-fluorophenyl)-pyrrolidin-1-ylmethanimine
CID 63179175
piperidin-1-yl-[4-(pyrazolo[4,5-c]pyridin-1-ylmethyl)phenyl]methanimine
CID 145324073
[3-chloro-5-fluoro-4-[(5-methyl-2,3-dihydroimidazo[1,2-b]pyrazol-5-ium-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine
CID 140790786
(2E)-2-[(5E)-5-ethylidene-1-[[4-(piperidine-1-carboximidoyl)phenyl]methyl]pyrazol-4-ylidene]-N-methylethanimine
CID 129229730
(3,4-dimethoxyphenyl)-piperidin-1-ylmethanimine
CID 63179479
(3-bromophenyl)-pyrrolidin-1-ylmethanimine
CID 62047755
(4-methylphenyl)-(4-methylpiperazin-1-yl)methanimine
CID 63179139
[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-piperidin-1-ylmethanone
CID 38000598
4-[(4-ethylpiperidin-1-yl)methyl]benzenecarboximidamide
CID 61420812
(4-butylpiperazin-1-yl)-(4-methylphenyl)methanimine
CID 91316469

Frequently Asked Questions

What is the IUPAC name of [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine?
The IUPAC name of [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine (CID 145324349) is [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine.
What is the SMILES notation for [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine?
The canonical SMILES for [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine is [H]/N=C(/c1ccc(CN2CCN3C2=CC=CC3CC)cc1)N1CCCC1.
What is the InChIKey of [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine?
The InChIKey is BJURCXWSJTVGHO-DQRAZIAOSA-N. The full InChI is InChI=1S/C21H28N4/c1-2-19-6-5-7-20-24(14-15-25(19)20)16-17-8-10-18(11-9-17)21(22)23-12-3-4-13-23/h5-11,19,22H,2-4,12-16H2,1H3/b22-21-.
What are the key properties of [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine?
[4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine has a molecular weight of 336.48 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(5-ethyl-3,5-dihydro-2H-imidazo[1,2-a]pyridin-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanimine is sourced from PubChem (CID 145324349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).