3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide

C23H30N4O — CID 42783722

IUPAC3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide
SMILESCc1cccn2c(C(CC(=O)NCC(C)C)c3ccc(N(C)C)cc3)cnc12
InChIInChI=1S/C23H30N4O/c1-16(2)14-24-22(28)13-20(18-8-10-19(11-9-18)26(4)5)21-15-25-23-17(3)7-6-12-27(21)23/h6-12,15-16,20H,13-14H2,1-5H3,(H,24,28)
InChIKeyGVPPUDXVCOKMSD-UHFFFAOYSA-N
MW378.52 g/mol
LogP4.00
Rot. Bonds7

About 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide

3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide (PubChem CID 42783722) has the molecular formula C23H30N4O and a molecular weight of 378.52 g/mol. Its IUPAC name is 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide
PubChem CID42783722
Molecular FormulaC23H30N4O
Molecular Weight378.52 g/mol
Exact Mass378.24
IUPAC Name3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide
SMILESCc1cccn2c(C(CC(=O)NCC(C)C)c3ccc(N(C)C)cc3)cnc12
InChIInChI=1S/C23H30N4O/c1-16(2)14-24-22(28)13-20(18-8-10-19(11-9-18)26(4)5)21-15-25-23-17(3)7-6-12-27(21)23/h6-12,15-16,20H,13-14H2,1-5H3,(H,24,28)
InChIKeyGVPPUDXVCOKMSD-UHFFFAOYSA-N
XLogP4.00
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 42783718
N-butyl-3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 3644707
(3S)-3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-piperidin-1-ylethyl)propanamide
CID 7306960
(3S)-3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-piperidin-1-ium-1-ylethyl)propanamide
CID 7306959
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 5072076
3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-(2-methylphenyl)-N-propan-2-ylpropanamide
CID 42783552
3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-(2-methylphenyl)-N-(pyridin-4-ylmethyl)propanamide
CID 42783565
(3S)-N-butyl-3-(3-methoxyphenyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 7332062
(3S)-3-(3-methoxyphenyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-phenylethyl)propanamide
CID 7115600
N-hexyl-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide
CID 5050639
1-(4-ethylpiperazin-1-yl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-phenylpropan-1-one
CID 4695381
1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-phenylpropan-1-one
CID 42783760

Frequently Asked Questions

What is the IUPAC name of 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide?
The IUPAC name of 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide (CID 42783722) is 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide?
The canonical SMILES for 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide is Cc1cccn2c(C(CC(=O)NCC(C)C)c3ccc(N(C)C)cc3)cnc12.
What is the InChIKey of 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide?
The InChIKey is GVPPUDXVCOKMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O/c1-16(2)14-24-22(28)13-20(18-8-10-19(11-9-18)26(4)5)21-15-25-23-17(3)7-6-12-27(21)23/h6-12,15-16,20H,13-14H2,1-5H3,(H,24,28).
What are the key properties of 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide?
3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide has a molecular weight of 378.52 g/mol, XLogP of 4.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(dimethylamino)phenyl]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 42783722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).