2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine

C11H12ClN3 — CID 115883601

IUPAC2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine
SMILESC=C(Cl)CNCc1cccc2nccn12
InChIInChI=1S/C11H12ClN3/c1-9(12)7-13-8-10-3-2-4-11-14-5-6-15(10)11/h2-6,13H,1,7-8H2
InChIKeyZIYBTNJUTVPFRF-UHFFFAOYSA-N
MW221.69 g/mol
LogP2.18
Rot. Bonds4

About 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine

2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine (PubChem CID 115883601) has the molecular formula C11H12ClN3 and a molecular weight of 221.69 g/mol. Its IUPAC name is 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine
PubChem CID115883601
Molecular FormulaC11H12ClN3
Molecular Weight221.69 g/mol
Exact Mass221.07
IUPAC Name2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine
SMILESC=C(Cl)CNCc1cccc2nccn12
InChIInChI=1S/C11H12ClN3/c1-9(12)7-13-8-10-3-2-4-11-14-5-6-15(10)11/h2-6,13H,1,7-8H2
InChIKeyZIYBTNJUTVPFRF-UHFFFAOYSA-N
XLogP2.18
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.69
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(imidazo[1,2-a]pyridin-5-ylmethyl)but-2-yn-1-amine
CID 115883630
N-(imidazo[1,2-a]pyridin-5-ylmethyl)-2-methoxyethanamine
CID 115883524
imidazo[1,2-a]pyridin-5-ylmethanethiol
CID 89093379
(1R,2R,3S)-3-(imidazo[1,2-a]pyridin-5-ylmethylamino)-2-pyrazol-1-ylcyclobutan-1-ol
CID 167926150
5-(bromomethyl)imidazo[1,2-a]pyridine;hydrobromide
CID 121232171
2-chloro-N-(quinolin-8-ylmethyl)prop-2-en-1-amine
CID 79003767
2-[ethyl-[3-(imidazo[1,2-a]pyridin-5-ylmethylamino)cyclobutyl]amino]acetic acid
CID 122042751
N-(imidazo[1,2-a]pyridin-5-ylmethyl)-2-methyl-5-phenyl-1,2,4-triazol-3-amine
CID 154745786
2-(imidazo[1,2-a]pyridin-5-ylamino)acetic acid
CID 162696041
1-[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]-N-(imidazo[1,2-a]pyridin-5-ylmethyl)methanamine
CID 128992159
5-(pyrrolidin-3-ylmethyl)imidazo[1,2-a]pyridine
CID 142415541
1-benzyl-3-(imidazo[1,2-a]pyridin-5-ylmethylamino)pyrrolidin-2-one
CID 154745464

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine?
The IUPAC name of 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine (CID 115883601) is 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine.
What is the SMILES notation for 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine?
The canonical SMILES for 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine is C=C(Cl)CNCc1cccc2nccn12.
What is the InChIKey of 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine?
The InChIKey is ZIYBTNJUTVPFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3/c1-9(12)7-13-8-10-3-2-4-11-14-5-6-15(10)11/h2-6,13H,1,7-8H2.
What are the key properties of 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine?
2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine has a molecular weight of 221.69 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(imidazo[1,2-a]pyridin-5-ylmethyl)prop-2-en-1-amine is sourced from PubChem (CID 115883601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).