2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine

C12H16ClN3 — CID 63387084

IUPAC2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
SMILESCCN(CCCl)Cc1cn2ccccc2n1
InChIInChI=1S/C12H16ClN3/c1-2-15(8-6-13)9-11-10-16-7-4-3-5-12(16)14-11/h3-5,7,10H,2,6,8-9H2,1H3
InChIKeyRFQLTSAMZXRBDX-UHFFFAOYSA-N
MW237.73 g/mol
LogP2.39
Rot. Bonds5

About 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine

2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine (PubChem CID 63387084) has the molecular formula C12H16ClN3 and a molecular weight of 237.73 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
PubChem CID63387084
Molecular FormulaC12H16ClN3
Molecular Weight237.73 g/mol
Exact Mass237.10
IUPAC Name2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
SMILESCCN(CCCl)Cc1cn2ccccc2n1
InChIInChI=1S/C12H16ClN3/c1-2-15(8-6-13)9-11-10-16-7-4-3-5-12(16)14-11/h3-5,7,10H,2,6,8-9H2,1H3
InChIKeyRFQLTSAMZXRBDX-UHFFFAOYSA-N
XLogP2.39
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.73
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine
CID 43137193
2-[ethyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 54900006
2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 107425654
2-N-ethyl-2-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropane-1,2-diamine
CID 62010368
2-[chloro(dideuterio)methyl]imidazo[1,2-a]pyridine;hydrochloride
CID 164900290
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
2-chloro-N-ethyl-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 82872228
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-(pyrrolidin-2-ylmethyl)butan-1-amine
CID 106604987
imidazo[1,2-a]pyridin-2-ylmethylazanium
CID 7012186
2-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-N,2-dimethylbutane-1,2-diamine
CID 62009772
[2-[[imidazo[1,2-a]pyridin-2-ylmethyl(methyl)amino]methyl]phenyl]methanamine
CID 60922596

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine?
The IUPAC name of 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine (CID 63387084) is 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine is CCN(CCCl)Cc1cn2ccccc2n1.
What is the InChIKey of 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine?
The InChIKey is RFQLTSAMZXRBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3/c1-2-15(8-6-13)9-11-10-16-7-4-3-5-12(16)14-11/h3-5,7,10H,2,6,8-9H2,1H3.
What are the key properties of 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine?
2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine has a molecular weight of 237.73 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 63387084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).