N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine

C14H19ClN4O — CID 95300913

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine
SMILESCN1CCO[C@H](CNCc2cn3cc(Cl)ccc3n2)C1
InChIInChI=1S/C14H19ClN4O/c1-18-4-5-20-13(10-18)7-16-6-12-9-19-8-11(15)2-3-14(19)17-12/h2-3,8-9,13,16H,4-7,10H2,1H3/t13-/m1/s1
InChIKeyBKSJPNPZAGCKMY-CYBMUJFWSA-N
MW294.79 g/mol
LogP1.41
Rot. Bonds4

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine (PubChem CID 95300913) has the molecular formula C14H19ClN4O and a molecular weight of 294.79 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine
PubChem CID95300913
Molecular FormulaC14H19ClN4O
Molecular Weight294.79 g/mol
Exact Mass294.12
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine
SMILESCN1CCO[C@H](CNCc2cn3cc(Cl)ccc3n2)C1
InChIInChI=1S/C14H19ClN4O/c1-18-4-5-20-13(10-18)7-16-6-12-9-19-8-11(15)2-3-14(19)17-12/h2-3,8-9,13,16H,4-7,10H2,1H3/t13-/m1/s1
InChIKeyBKSJPNPZAGCKMY-CYBMUJFWSA-N
XLogP1.41
TPSA41.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.79
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine (CID 95300913) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine is CN1CCO[C@H](CNCc2cn3cc(Cl)ccc3n2)C1.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine?
The InChIKey is BKSJPNPZAGCKMY-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H19ClN4O/c1-18-4-5-20-13(10-18)7-16-6-12-9-19-8-11(15)2-3-14(19)17-12/h2-3,8-9,13,16H,4-7,10H2,1H3/t13-/m1/s1.
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine has a molecular weight of 294.79 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine is sourced from PubChem (CID 95300913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).