N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline

C23H23N3 — CID 166067980

IUPACN,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
SMILESCc1cc(N(C)C)ccc1Cc1c(-c2ccccc2)nc2ccccn12
InChIInChI=1S/C23H23N3/c1-17-15-20(25(2)3)13-12-19(17)16-21-23(18-9-5-4-6-10-18)24-22-11-7-8-14-26(21)22/h4-15H,16H2,1-3H3
InChIKeyQKZICMMNSVZVFM-UHFFFAOYSA-N
MW341.46 g/mol
LogP4.97
Rot. Bonds4

About N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline

N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline (PubChem CID 166067980) has the molecular formula C23H23N3 and a molecular weight of 341.46 g/mol. Its IUPAC name is N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline.

Molecular Properties

Compound NameN,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
PubChem CID166067980
Molecular FormulaC23H23N3
Molecular Weight341.46 g/mol
Exact Mass341.19
IUPAC NameN,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
SMILESCc1cc(N(C)C)ccc1Cc1c(-c2ccccc2)nc2ccccn12
InChIInChI=1S/C23H23N3/c1-17-15-20(25(2)3)13-12-19(17)16-21-23(18-9-5-4-6-10-18)24-22-11-7-8-14-26(21)22/h4-15H,16H2,1-3H3
InChIKeyQKZICMMNSVZVFM-UHFFFAOYSA-N
XLogP4.97
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(3-benzylimidazo[1,2-a]pyridin-2-yl)-N,N-dimethylaniline
CID 56600426
N,N-dimethyl-4-[[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]aniline
CID 166067979
4-[[2-(4-bromophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-N,N-dimethylaniline
CID 166067981
N-methyl-N-pentyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 166067984
(2-phenylimidazo[1,2-a]pyridin-3-yl)methanol
CID 15455971
3-[(4-methoxy-2-methylphenyl)methyl]-6-methyl-2-phenylimidazo[1,2-a]pyridine
CID 51359385
3-(chloromethyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 39126150
3-(chloromethyl)-2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine
CID 39132917
4-methyl-N-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 156789846
3-[(4-methoxy-2-methylphenyl)methyl]-2-phenylimidazo[2,1-a]isoquinoline
CID 51359837
3-[3-[(dimethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]aniline
CID 39120445
1-(3-methoxyphenyl)-N-methyl-N-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine
CID 30136620

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline?
The IUPAC name of N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline (CID 166067980) is N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline.
What is the SMILES notation for N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline?
The canonical SMILES for N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline is Cc1cc(N(C)C)ccc1Cc1c(-c2ccccc2)nc2ccccn12.
What is the InChIKey of N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline?
The InChIKey is QKZICMMNSVZVFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3/c1-17-15-20(25(2)3)13-12-19(17)16-21-23(18-9-5-4-6-10-18)24-22-11-7-8-14-26(21)22/h4-15H,16H2,1-3H3.
What are the key properties of N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline?
N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline has a molecular weight of 341.46 g/mol, XLogP of 4.97, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]aniline is sourced from PubChem (CID 166067980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).