2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine

C26H34N6 — CID 11854137

IUPAC2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine
SMILESCN1CCC(N(C)c2cccc3nc(CN4CCC[C@H]5CCc6cccnc6[C@H]54)cn23)C1
InChIInChI=1S/C26H34N6/c1-29-15-12-22(18-29)30(2)24-9-3-8-23-28-21(17-32(23)24)16-31-14-5-7-20-11-10-19-6-4-13-27-25(19)26(20)31/h3-4,6,8-9,13,17,20,22,26H,5,7,10-12,14-16,18H2,1-2H3/t20-,22?,26-/m0/s1
InChIKeyICZPLMCVXJLMHV-GCNITNNDSA-N
MW430.60 g/mol
LogP3.77
Rot. Bonds4

About 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine

2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine (PubChem CID 11854137) has the molecular formula C26H34N6 and a molecular weight of 430.60 g/mol. Its IUPAC name is 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine.

Molecular Properties

Compound Name2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine
PubChem CID11854137
Molecular FormulaC26H34N6
Molecular Weight430.60 g/mol
Exact Mass430.28
IUPAC Name2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine
SMILESCN1CCC(N(C)c2cccc3nc(CN4CCC[C@H]5CCc6cccnc6[C@H]54)cn23)C1
InChIInChI=1S/C26H34N6/c1-29-15-12-22(18-29)30(2)24-9-3-8-23-28-21(17-32(23)24)16-31-14-5-7-20-11-10-19-6-4-13-27-25(19)26(20)31/h3-4,6,8-9,13,17,20,22,26H,5,7,10-12,14-16,18H2,1-2H3/t20-,22?,26-/m0/s1
InChIKeyICZPLMCVXJLMHV-GCNITNNDSA-N
XLogP3.77
TPSA39.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.60
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine with MolForge

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Launch Full Analysis

Related Compounds

Gsk-812397
CID 11718722
Fazadinium Bromide
CID 6321422
6-Methyl-2-(4-methylphenyl)imidazo(1,2-a)pyridine
CID 667720
2,6-Diphenylimidazo[1,2-a]pyridine
CID 58880626
4-(7-((Dimethylamino)methyl)-2-(4-fluorophenyl)imidazo(1,2-a)pyridin-3-yl)pyrimidin-2-amine
CID 10133248
6-[3-(2,2-Difluoroethyl)-5-(6-methylpyridin-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine
CID 135233366
N-cyclohexyl-4-(imidazo(1,2-a)pyridin-3-yl)-N-methylpyrimidin-2-amine
CID 24801862
Eapb-0203
CID 24779760
3,7-Diphenylimidazo[1,2-a]pyridine
CID 5329339
7-Phenyl-3-(pyridin-4-yl)imidazo[1,2-a]pyridine
CID 5329340
Imidazopyridine 10b
CID 5329341
Imidazopyridine 18d
CID 5329354

Frequently Asked Questions

What is the IUPAC name of 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine?
The IUPAC name of 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine (CID 11854137) is 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine.
What is the SMILES notation for 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine?
The canonical SMILES for 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine is CN1CCC(N(C)c2cccc3nc(CN4CCC[C@H]5CCc6cccnc6[C@H]54)cn23)C1.
What is the InChIKey of 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine?
The InChIKey is ICZPLMCVXJLMHV-GCNITNNDSA-N. The full InChI is InChI=1S/C26H34N6/c1-29-15-12-22(18-29)30(2)24-9-3-8-23-28-21(17-32(23)24)16-31-14-5-7-20-11-10-19-6-4-13-27-25(19)26(20)31/h3-4,6,8-9,13,17,20,22,26H,5,7,10-12,14-16,18H2,1-2H3/t20-,22?,26-/m0/s1.
What are the key properties of 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine?
2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine has a molecular weight of 430.60 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(4aR,10bS)-3,4,4a,5,6,10b-hexahydro-2H-1,10-phenanthrolin-1-yl]methyl]-N-methyl-N-(1-methylpyrrolidin-3-yl)imidazo[1,2-a]pyridin-5-amine is sourced from PubChem (CID 11854137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).