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

C24H32N4O — CID 42783718

IUPAC3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCc1cccn2c(C(CC(=O)NCCC(C)C)c3ccc(N(C)C)cc3)cnc12
InChIInChI=1S/C24H32N4O/c1-17(2)12-13-25-23(29)15-21(19-8-10-20(11-9-19)27(4)5)22-16-26-24-18(3)7-6-14-28(22)24/h6-11,14,16-17,21H,12-13,15H2,1-5H3,(H,25,29)
InChIKeyOSBKUNRSVVWBCH-UHFFFAOYSA-N
MW392.55 g/mol
LogP4.39
Rot. Bonds8

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

3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide (PubChem CID 42783718) has the molecular formula C24H32N4O and a molecular weight of 392.55 g/mol. Its IUPAC name is 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide.

Molecular Properties

Compound Name3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
PubChem CID42783718
Molecular FormulaC24H32N4O
Molecular Weight392.55 g/mol
Exact Mass392.26
IUPAC Name3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCc1cccn2c(C(CC(=O)NCCC(C)C)c3ccc(N(C)C)cc3)cnc12
InChIInChI=1S/C24H32N4O/c1-17(2)12-13-25-23(29)15-21(19-8-10-20(11-9-19)27(4)5)22-16-26-24-18(3)7-6-14-28(22)24/h6-11,14,16-17,21H,12-13,15H2,1-5H3,(H,25,29)
InChIKeyOSBKUNRSVVWBCH-UHFFFAOYSA-N
XLogP4.39
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.55
LogP ≤ 54.39
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]-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylpropyl)propanamide
CID 42783722
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-(3,5-dimethoxyphenyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-N-(2-phenylethyl)propanamide
CID 3274664
(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
3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-(2-methylphenyl)-N-propan-2-ylpropanamide
CID 42783552
N-hexyl-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide
CID 5050639
3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-(2-methylphenyl)-N-(pyridin-4-ylmethyl)propanamide
CID 42783565
N-(3,3-diphenylpropyl)-3-imidazo[1,2-a]pyridin-3-yl-3-phenylpropanamide
CID 5074475

Frequently Asked Questions

What is the IUPAC name of 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide?
The IUPAC name of 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide (CID 42783718) is 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide.
What is the SMILES notation for 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide?
The canonical SMILES for 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide is Cc1cccn2c(C(CC(=O)NCCC(C)C)c3ccc(N(C)C)cc3)cnc12.
What is the InChIKey of 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide?
The InChIKey is OSBKUNRSVVWBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N4O/c1-17(2)12-13-25-23(29)15-21(19-8-10-20(11-9-19)27(4)5)22-16-26-24-18(3)7-6-14-28(22)24/h6-11,14,16-17,21H,12-13,15H2,1-5H3,(H,25,29).
What are the key properties of 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide?
3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide has a molecular weight of 392.55 g/mol, XLogP of 4.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(dimethylamino)phenyl]-N-(3-methylbutyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)propanamide is sourced from PubChem (CID 42783718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).