N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine

C18H21N3 — CID 164536311

IUPACN-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine
SMILESCCNC(C)(C)c1cccc(-c2ccc3nccn3c2)c1
InChIInChI=1S/C18H21N3/c1-4-20-18(2,3)16-7-5-6-14(12-16)15-8-9-17-19-10-11-21(17)13-15/h5-13,20H,4H2,1-3H3
InChIKeyVKHGIFUUQGYRHH-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.85
Rot. Bonds4

About N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine

N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine (PubChem CID 164536311) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine
PubChem CID164536311
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC NameN-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine
SMILESCCNC(C)(C)c1cccc(-c2ccc3nccn3c2)c1
InChIInChI=1S/C18H21N3/c1-4-20-18(2,3)16-7-5-6-14(12-16)15-8-9-17-19-10-11-21(17)13-15/h5-13,20H,4H2,1-3H3
InChIKeyVKHGIFUUQGYRHH-UHFFFAOYSA-N
XLogP3.85
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine?
The IUPAC name of N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine (CID 164536311) is N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine.
What is the SMILES notation for N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine?
The canonical SMILES for N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine is CCNC(C)(C)c1cccc(-c2ccc3nccn3c2)c1.
What is the InChIKey of N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine?
The InChIKey is VKHGIFUUQGYRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-4-20-18(2,3)16-7-5-6-14(12-16)15-8-9-17-19-10-11-21(17)13-15/h5-13,20H,4H2,1-3H3.
What are the key properties of N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine?
N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine has a molecular weight of 279.39 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine is sourced from PubChem (CID 164536311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).