N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine

C20H23N5 — CID 67730497

IUPACN-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1ccn2c(C)c(CCc3ccc(NC4=NCCN4)cc3)nc2c1
InChIInChI=1S/C20H23N5/c1-14-9-12-25-15(2)18(24-19(25)13-14)8-5-16-3-6-17(7-4-16)23-20-21-10-11-22-20/h3-4,6-7,9,12-13H,5,8,10-11H2,1-2H3,(H2,21,22,23)
InChIKeyOFRRUBVNDNCXPJ-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.11
Rot. Bonds4

About N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine

N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 67730497) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID67730497
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC NameN-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1ccn2c(C)c(CCc3ccc(NC4=NCCN4)cc3)nc2c1
InChIInChI=1S/C20H23N5/c1-14-9-12-25-15(2)18(24-19(25)13-14)8-5-16-3-6-17(7-4-16)23-20-21-10-11-22-20/h3-4,6-7,9,12-13H,5,8,10-11H2,1-2H3,(H2,21,22,23)
InChIKeyOFRRUBVNDNCXPJ-UHFFFAOYSA-N
XLogP3.11
TPSA53.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine (CID 67730497) is N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine is Cc1ccn2c(C)c(CCc3ccc(NC4=NCCN4)cc3)nc2c1.
What is the InChIKey of N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is OFRRUBVNDNCXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5/c1-14-9-12-25-15(2)18(24-19(25)13-14)8-5-16-3-6-17(7-4-16)23-20-21-10-11-22-20/h3-4,6-7,9,12-13H,5,8,10-11H2,1-2H3,(H2,21,22,23).
What are the key properties of N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine?
N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 333.44 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 67730497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).