N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine

C26H29N5 — CID 143198338

IUPACN-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine
SMILESCN1CCN(c2cccc3nc(CNCc4ccc(-c5ccccc5)cc4)cn23)CC1
InChIInChI=1S/C26H29N5/c1-29-14-16-30(17-15-29)26-9-5-8-25-28-24(20-31(25)26)19-27-18-21-10-12-23(13-11-21)22-6-3-2-4-7-22/h2-13,20,27H,14-19H2,1H3
InChIKeySLPOUOZEMZWVAZ-UHFFFAOYSA-N
MW411.55 g/mol
LogP4.04
Rot. Bonds6

About N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine

N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine (PubChem CID 143198338) has the molecular formula C26H29N5 and a molecular weight of 411.55 g/mol. Its IUPAC name is N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine.

Molecular Properties

Compound NameN-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine
PubChem CID143198338
Molecular FormulaC26H29N5
Molecular Weight411.55 g/mol
Exact Mass411.24
IUPAC NameN-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine
SMILESCN1CCN(c2cccc3nc(CNCc4ccc(-c5ccccc5)cc4)cn23)CC1
InChIInChI=1S/C26H29N5/c1-29-14-16-30(17-15-29)26-9-5-8-25-28-24(20-31(25)26)19-27-18-21-10-12-23(13-11-21)22-6-3-2-4-7-22/h2-13,20,27H,14-19H2,1H3
InChIKeySLPOUOZEMZWVAZ-UHFFFAOYSA-N
XLogP4.04
TPSA35.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.55
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-pyridin-2-ylmethanamine;5,6,7,8-tetrahydroquinoline
CID 143208914
[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanol
CID 58985317
[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline
CID 143196391
5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine-2-carbaldehyde;oxalic acid
CID 71742363
(E)-4-[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]but-3-en-2-one
CID 145424612
(2S)-2-amino-N-[[4-[[[6-(4-methylpiperazin-1-yl)-2-pyridinyl]methylamino]methyl]phenyl]methyl]propanamide
CID 154969388
5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine
CID 141140259
N-methyl-1-[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]ethanamine;5,6,7,8-tetrahydroquinoline
CID 143198321
N-[(4-methylphenyl)methyl]-4-(4-methylpiperazin-1-yl)-6-phenylpyrimidin-2-amine
CID 112936254
4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide
CID 131889625
4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid
CID 68647071
1-methyl-N-[(4-phenylphenyl)methyl]piperidin-4-amine
CID 43215927

Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine?
The IUPAC name of N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine (CID 143198338) is N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine.
What is the SMILES notation for N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine?
The canonical SMILES for N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine is CN1CCN(c2cccc3nc(CNCc4ccc(-c5ccccc5)cc4)cn23)CC1.
What is the InChIKey of N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine?
The InChIKey is SLPOUOZEMZWVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N5/c1-29-14-16-30(17-15-29)26-9-5-8-25-28-24(20-31(25)26)19-27-18-21-10-12-23(13-11-21)22-6-3-2-4-7-22/h2-13,20,27H,14-19H2,1H3.
What are the key properties of N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine?
N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine has a molecular weight of 411.55 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine is sourced from PubChem (CID 143198338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).